1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine

C14H25N3 — CID 106571771

IUPAC1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine
SMILESCCCNc1nccn1CC1CCC(C)CC1
InChIInChI=1S/C14H25N3/c1-3-8-15-14-16-9-10-17(14)11-13-6-4-12(2)5-7-13/h9-10,12-13H,3-8,11H2,1-2H3,(H,15,16)
InChIKeyDDJWLAWGBXPLHV-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.53
Rot. Bonds5

About 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine

1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine (PubChem CID 106571771) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine.

Molecular Properties

Compound Name1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine
PubChem CID106571771
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine
SMILESCCCNc1nccn1CC1CCC(C)CC1
InChIInChI=1S/C14H25N3/c1-3-8-15-14-16-9-10-17(14)11-13-6-4-12(2)5-7-13/h9-10,12-13H,3-8,11H2,1-2H3,(H,15,16)
InChIKeyDDJWLAWGBXPLHV-UHFFFAOYSA-N
XLogP3.53
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methoxypropyl)-1-[(4-methylcyclohexyl)methyl]imidazol-2-amine
CID 106571770
1-(2-cyclopropylethyl)-N-propylimidazol-2-amine
CID 106575826
N-[2-(4-methylcyclohexyl)ethyl]-1-propylimidazol-2-amine
CID 106574294
N-butyl-1-[2-(4-methylcyclohexyl)ethyl]imidazol-2-amine
CID 106574296
1-(cyclobutylmethyl)-N-ethylimidazol-2-amine
CID 106561466
N-propyl-1-(thiolan-2-ylmethyl)imidazol-2-amine
CID 106576814
1-(3-methoxypropyl)-N-[2-(4-methylcyclohexyl)ethyl]imidazol-2-amine
CID 106574312
1-cyclopropyl-N-propylimidazol-2-amine
CID 106554744
1-[2-(4-methylcyclohexyl)ethyl]-N-(2-methylpropyl)imidazol-2-amine
CID 106574335
1-(3,3-dimethylbutyl)-N-propylimidazol-2-amine
CID 106581758
N-butyl-1-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560081
1-(2-cyclopropylethyl)-N-ethylimidazol-2-amine
CID 106575831

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine?
The IUPAC name of 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine (CID 106571771) is 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine.
What is the SMILES notation for 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine?
The canonical SMILES for 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine is CCCNc1nccn1CC1CCC(C)CC1.
What is the InChIKey of 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine?
The InChIKey is DDJWLAWGBXPLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-3-8-15-14-16-9-10-17(14)11-13-6-4-12(2)5-7-13/h9-10,12-13H,3-8,11H2,1-2H3,(H,15,16).
What are the key properties of 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine?
1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methylcyclohexyl)methyl]-N-propylimidazol-2-amine is sourced from PubChem (CID 106571771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).