1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine

C11H19N3 — CID 64918015

IUPAC1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine
SMILESCCC(NCc1nccn1C)C1CC1
InChIInChI=1S/C11H19N3/c1-3-10(9-4-5-9)13-8-11-12-6-7-14(11)2/h6-7,9-10,13H,3-5,8H2,1-2H3
InChIKeyLSOUDNFVRIZALV-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.70
Rot. Bonds5

About 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine

1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine (PubChem CID 64918015) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine
PubChem CID64918015
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine
SMILESCCC(NCc1nccn1C)C1CC1
InChIInChI=1S/C11H19N3/c1-3-10(9-4-5-9)13-8-11-12-6-7-14(11)2/h6-7,9-10,13H,3-5,8H2,1-2H3
InChIKeyLSOUDNFVRIZALV-UHFFFAOYSA-N
XLogP1.70
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-[[1-(difluoromethyl)imidazol-2-yl]methyl]propan-1-amine
CID 115714091
N-[(1-methylimidazol-2-yl)methyl]pentan-3-amine
CID 43088152
N-[(1-methylimidazol-2-yl)methyl]-1-(1-methylpiperidin-4-yl)ethanamine
CID 63292117
1-(4-tert-butylcyclohexyl)-N-ethyl-2-(1-methylimidazol-2-yl)ethanamine
CID 79751363
(1S)-1-cyclopentyl-N-[(1-methylimidazol-2-yl)methyl]ethanamine
CID 81386227
1-cyclopropyl-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
CID 63352794
[2-(1-methylimidazol-2-yl)-1-(4-propan-2-ylcyclohexyl)ethyl]hydrazine
CID 105232616
N-ethyl-2-[(1-methylimidazol-2-yl)methylamino]propanamide
CID 60696120
N-methyl-1-(4-methylcyclohexyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 79752220
N-[(1-methylimidazol-2-yl)methyl]-1-(oxolan-3-yl)ethanamine
CID 115655247
N-[(1-methylimidazol-2-yl)methyl]cyclobutanamine
CID 62415731
N-[(1-methylimidazol-2-yl)methyl]undecan-6-amine
CID 63292288

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine (CID 64918015) is 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine is CCC(NCc1nccn1C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine?
The InChIKey is LSOUDNFVRIZALV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-10(9-4-5-9)13-8-11-12-6-7-14(11)2/h6-7,9-10,13H,3-5,8H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine?
1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine has a molecular weight of 193.29 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 64918015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).