N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine

C14H21N5S — CID 91834125

IUPACN-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine
SMILESCC(C)c1nnsc1CN(Cc1nccn1C)C1CC1
InChIInChI=1S/C14H21N5S/c1-10(2)14-12(20-17-16-14)8-19(11-4-5-11)9-13-15-6-7-18(13)3/h6-7,10-11H,4-5,8-9H2,1-3H3
InChIKeyZDUHXSXEBAADFJ-UHFFFAOYSA-N
MW291.42 g/mol
LogP2.56
Rot. Bonds6

About N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine

N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine (PubChem CID 91834125) has the molecular formula C14H21N5S and a molecular weight of 291.42 g/mol. Its IUPAC name is N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine
PubChem CID91834125
Molecular FormulaC14H21N5S
Molecular Weight291.42 g/mol
Exact Mass291.15
IUPAC NameN-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine
SMILESCC(C)c1nnsc1CN(Cc1nccn1C)C1CC1
InChIInChI=1S/C14H21N5S/c1-10(2)14-12(20-17-16-14)8-19(11-4-5-11)9-13-15-6-7-18(13)3/h6-7,10-11H,4-5,8-9H2,1-3H3
InChIKeyZDUHXSXEBAADFJ-UHFFFAOYSA-N
XLogP2.56
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine 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

2-[cyclopropyl-[2-(1-methylimidazol-2-yl)ethyl]amino]ethanol
CID 114531207
N-[(2-cyclohexylpyrimidin-5-yl)methyl]-N-[(1-methylimidazol-2-yl)methyl]cyclopropanamine
CID 77092489
4-[[cyclopropyl-[2-(1-methylimidazol-2-yl)ethyl]amino]methyl]aniline
CID 114528265
N-[(1-methylimidazol-2-yl)methyl]-N-[[(3S)-oxan-3-yl]methyl]cyclopropanamine
CID 124757448
N-[(E)-3-(furan-2-yl)-2-methylprop-2-enyl]-N-[(1-methylimidazol-2-yl)methyl]cyclopropanamine
CID 50972306
N-(furan-3-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]cyclohexanamine
CID 122158285
2-amino-N-cyclopropyl-4-methyl-N-[(1-methylimidazol-2-yl)methyl]pentanamide
CID 54871592
2-amino-N-cyclopropyl-2-ethyl-N-[(1-methylimidazol-2-yl)methyl]butanamide
CID 79813594
N-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]-N-[(1-methylimidazol-2-yl)methyl]cyclopropanamine
CID 56705149
5-(aminomethyl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4-propan-2-yl-1,3-thiazol-2-amine
CID 79393591
2-[cyclopentyl-[2-(1-methylimidazol-2-yl)ethyl]amino]ethanol
CID 114531217
5-N,1-dimethyl-5-N-[(1-methylimidazol-2-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine
CID 66012525

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine (CID 91834125) is N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine is CC(C)c1nnsc1CN(Cc1nccn1C)C1CC1.
What is the InChIKey of N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine?
The InChIKey is ZDUHXSXEBAADFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5S/c1-10(2)14-12(20-17-16-14)8-19(11-4-5-11)9-13-15-6-7-18(13)3/h6-7,10-11H,4-5,8-9H2,1-3H3.
What are the key properties of N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine?
N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine has a molecular weight of 291.42 g/mol, XLogP of 2.56, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylimidazol-2-yl)methyl]-N-[(4-propan-2-ylthiadiazol-5-yl)methyl]cyclopropanamine is sourced from PubChem (CID 91834125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).