N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine

C15H28N4 — CID 106579421

IUPACN-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine
SMILESCCCCNc1nccn1CC1(N(C)C)CCCC1
InChIInChI=1S/C15H28N4/c1-4-5-10-16-14-17-11-12-19(14)13-15(18(2)3)8-6-7-9-15/h11-12H,4-10,13H2,1-3H3,(H,16,17)
InChIKeyWIXVAABKCVPVGA-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.97
Rot. Bonds7

About N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine

N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine (PubChem CID 106579421) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine.

Molecular Properties

Compound NameN-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine
PubChem CID106579421
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC NameN-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine
SMILESCCCCNc1nccn1CC1(N(C)C)CCCC1
InChIInChI=1S/C15H28N4/c1-4-5-10-16-14-17-11-12-19(14)13-15(18(2)3)8-6-7-9-15/h11-12H,4-10,13H2,1-3H3,(H,16,17)
InChIKeyWIXVAABKCVPVGA-UHFFFAOYSA-N
XLogP2.97
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine 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

N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]-4-methylimidazol-2-amine
CID 106579428
N-butyl-1-hexylimidazol-2-amine
CID 106573794
1-ethyl-N-octylimidazol-2-amine
CID 115568972
N-hexyl-1-propylimidazol-2-amine
CID 106573792
N-butyl-1-[2-[di(propan-2-yl)amino]ethyl]imidazol-2-amine
CID 106555556
N-butyl-1-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560081
N-(1-ethylimidazol-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 62138038
N-butyl-1-(2-methyl-2-methylsulfanylpropyl)imidazol-2-amine
CID 106580890
N-butyl-1-(thian-2-ylmethyl)imidazol-2-amine
CID 106577111
N-butyl-1-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
CID 106565244
N-butyl-1-(2-methylsulfanylpropyl)imidazol-2-amine
CID 106580940
N-[[1-(dimethylamino)cyclobutyl]methyl]-1-prop-2-enylimidazol-2-amine
CID 106583084

Frequently Asked Questions

What is the IUPAC name of N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine?
The IUPAC name of N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine (CID 106579421) is N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine.
What is the SMILES notation for N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine?
The canonical SMILES for N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine is CCCCNc1nccn1CC1(N(C)C)CCCC1.
What is the InChIKey of N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine?
The InChIKey is WIXVAABKCVPVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-4-5-10-16-14-17-11-12-19(14)13-15(18(2)3)8-6-7-9-15/h11-12H,4-10,13H2,1-3H3,(H,16,17).
What are the key properties of N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine?
N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine has a molecular weight of 264.42 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-1-[[1-(dimethylamino)cyclopentyl]methyl]imidazol-2-amine is sourced from PubChem (CID 106579421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).