N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine

C16H28N4 — CID 105420681

IUPACN,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine
SMILESCCCc1nc2c(n1CC1(N(C)C)CCC1)CCNC2
InChIInChI=1S/C16H28N4/c1-4-6-15-18-13-11-17-10-7-14(13)20(15)12-16(19(2)3)8-5-9-16/h17H,4-12H2,1-3H3
InChIKeyBQUVEHWHBXXQHK-UHFFFAOYSA-N
MW276.43 g/mol
LogP1.97
Rot. Bonds5

About N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine

N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine (PubChem CID 105420681) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine
PubChem CID105420681
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC NameN,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine
SMILESCCCc1nc2c(n1CC1(N(C)C)CCC1)CCNC2
InChIInChI=1S/C16H28N4/c1-4-6-15-18-13-11-17-10-7-14(13)20(15)12-16(19(2)3)8-5-9-16/h17H,4-12H2,1-3H3
InChIKeyBQUVEHWHBXXQHK-UHFFFAOYSA-N
XLogP1.97
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine with MolForge

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Related Compounds

1-(1-ethylcyclobutyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 113489177
N,N-dimethyl-4-(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)butan-1-amine
CID 64857574
N-propan-2-yl-2-(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)acetamide
CID 64858304
2-propyl-1-(2,2,3,3-tetramethylcyclopropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 79350712
1-(2-methylsulfinylpropyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 113484502
1-[(1-methylcyclopentyl)methyl]-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856765
N,N-dimethyl-2-(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)aniline
CID 106760850
1-(2,3-dimethylcyclohexyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857898
2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-N,N-dimethylacetamide
CID 64856742
1-(2-methyloxolan-3-yl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 82735992
1-(2-ethylphenyl)-2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857130
N,N-diethyl-2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)ethanamine
CID 64857512

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine?
The IUPAC name of N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine (CID 105420681) is N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine is CCCc1nc2c(n1CC1(N(C)C)CCC1)CCNC2.
What is the InChIKey of N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine?
The InChIKey is BQUVEHWHBXXQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-4-6-15-18-13-11-17-10-7-14(13)20(15)12-16(19(2)3)8-5-9-16/h17H,4-12H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine?
N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine has a molecular weight of 276.43 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(2-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 105420681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).