N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine

C13H23N3 — CID 106572272

IUPACN-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine
SMILESCCCn1ccnc1NCC1(C)CCCC1
InChIInChI=1S/C13H23N3/c1-3-9-16-10-8-14-12(16)15-11-13(2)6-4-5-7-13/h8,10H,3-7,9,11H2,1-2H3,(H,14,15)
InChIKeyNNOPAFZAVHKVIX-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.29
Rot. Bonds5

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

N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine (PubChem CID 106572272) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine.

Molecular Properties

Compound NameN-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine
PubChem CID106572272
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine
SMILESCCCn1ccnc1NCC1(C)CCCC1
InChIInChI=1S/C13H23N3/c1-3-9-16-10-8-14-12(16)15-11-13(2)6-4-5-7-13/h8,10H,3-7,9,11H2,1-2H3,(H,14,15)
InChIKeyNNOPAFZAVHKVIX-UHFFFAOYSA-N
XLogP3.29
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(1-methylcyclopentyl)methylamino]-1-propylpyrazin-2-one
CID 63830300
3-[(1,4-dimethylpiperidin-4-yl)methylamino]-1-propylpyrazin-2-one
CID 107164468
1-[[(1-ethylimidazol-2-yl)amino]methyl]cyclopentan-1-ol
CID 65110887
N-[(1-methylcyclopentyl)methyl]-1-phenylimidazol-2-amine
CID 106572301
N-hexyl-1-propylimidazol-2-amine
CID 106573792
N-[(1-methylcyclopentyl)methyl]-2-(2-methylimidazol-1-yl)ethanamine
CID 63821869
1-(1-ethylcyclopentyl)-N-methyl-1-(1-propylimidazol-2-yl)methanamine
CID 115858981
N-[2-(4-methylcyclohexyl)ethyl]-1-propylimidazol-2-amine
CID 106574294
N-(4-methylpentyl)-1-propylimidazol-2-amine
CID 106572167
N-[(1-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 63822155
N-(3,5-dimethylphenyl)-1-propylimidazol-2-amine
CID 106559204
N,N-dimethyl-1-[methylamino-(1-propylimidazol-2-yl)methyl]cycloheptan-1-amine
CID 79064561

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine?
The IUPAC name of N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine (CID 106572272) is N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine.
What is the SMILES notation for N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine?
The canonical SMILES for N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine is CCCn1ccnc1NCC1(C)CCCC1.
What is the InChIKey of N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine?
The InChIKey is NNOPAFZAVHKVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-3-9-16-10-8-14-12(16)15-11-13(2)6-4-5-7-13/h8,10H,3-7,9,11H2,1-2H3,(H,14,15).
What are the key properties of N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine?
N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine has a molecular weight of 221.35 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclopentyl)methyl]-1-propylimidazol-2-amine is sourced from PubChem (CID 106572272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).