N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine

C16H24N4O — CID 97466923

IUPACN,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine
SMILESCc1ccc(CN2CCc3ncc(CN(C)C)n3CC2)o1
InChIInChI=1S/C16H24N4O/c1-13-4-5-15(21-13)12-19-7-6-16-17-10-14(11-18(2)3)20(16)9-8-19/h4-5,10H,6-9,11-12H2,1-3H3
InChIKeyUVIZLBSHVLAPGK-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.90
Rot. Bonds4

About N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine

N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine (PubChem CID 97466923) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine
PubChem CID97466923
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine
SMILESCc1ccc(CN2CCc3ncc(CN(C)C)n3CC2)o1
InChIInChI=1S/C16H24N4O/c1-13-4-5-15(21-13)12-19-7-6-16-17-10-14(11-18(2)3)20(16)9-8-19/h4-5,10H,6-9,11-12H2,1-3H3
InChIKeyUVIZLBSHVLAPGK-UHFFFAOYSA-N
XLogP1.90
TPSA37.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-[(5-methylfuran-2-yl)methyl]-3-propan-2-yl-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepine
CID 25295315
1-[7-(1,3-benzodioxol-5-ylmethyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]-N,N-dimethylmethanamine;bis(2,2,2-trifluoroacetic acid)
CID 155844851
8-methyl-7-[(5-methylfuran-2-yl)methyl]-3-[(4-methylpiperazin-1-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 131659648
[7-[(5-methylfuran-2-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone
CID 97468792
N,N-dimethyl-2-[[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]methoxy]ethanamine;bis(2,2,2-trifluoroacetic acid)
CID 118746010
N-[1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]ethyl]pyridine-3-carboxamide
CID 45200763
N-[[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]methyl]pyridine-2-carboxamide
CID 126464392
N-[1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]ethyl]-3-phenylpropanamide
CID 45200657
3-[4-[(5-methylfuran-2-yl)methyl]piperazin-1-yl]propan-1-amine
CID 54855936
4-[[7-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methyl]morpholine
CID 134076251
N-methyl-1-[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]-N-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]methanamine
CID 42515245
N,N-dimethyl-3-(pyrrolidin-1-ylmethyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-7-carboxamide
CID 97390202

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine (CID 97466923) is N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine is Cc1ccc(CN2CCc3ncc(CN(C)C)n3CC2)o1.
What is the InChIKey of N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine?
The InChIKey is UVIZLBSHVLAPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-13-4-5-15(21-13)12-19-7-6-16-17-10-14(11-18(2)3)20(16)9-8-19/h4-5,10H,6-9,11-12H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine?
N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine has a molecular weight of 288.39 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[7-[(5-methylfuran-2-yl)methyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepin-3-yl]methanamine is sourced from PubChem (CID 97466923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).