N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine

C14H25N3O — CID 113432918

IUPACN-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
SMILESCOC1(c2ncc(CNC(C)(C)C)[nH]2)CCCC1
InChIInChI=1S/C14H25N3O/c1-13(2,3)16-10-11-9-15-12(17-11)14(18-4)7-5-6-8-14/h9,16H,5-8,10H2,1-4H3,(H,15,17)
InChIKeyBPLRZGXABYFHKG-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.71
Rot. Bonds4

About N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine

N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine (PubChem CID 113432918) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
PubChem CID113432918
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
SMILESCOC1(c2ncc(CNC(C)(C)C)[nH]2)CCCC1
InChIInChI=1S/C14H25N3O/c1-13(2,3)16-10-11-9-15-12(17-11)14(18-4)7-5-6-8-14/h9,16H,5-8,10H2,1-4H3,(H,15,17)
InChIKeyBPLRZGXABYFHKG-UHFFFAOYSA-N
XLogP2.71
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-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-[[2-(1-methoxy-3-methylcyclohexyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
CID 116779851
1-[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]-N-methylmethanamine
CID 104611931
N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]propan-2-amine
CID 104611933
2-methoxy-N-[[2-(1-methoxycycloheptyl)-1H-imidazol-5-yl]methyl]ethanamine
CID 116779879
[2-(1-methoxycyclohexyl)-1H-imidazol-5-yl]methanamine
CID 116779739
N-[[2-(1-ethoxy-4-methylcyclohexyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine
CID 116779838
2-methyl-N-[(2-methyl-1H-imidazol-5-yl)methyl]propan-2-amine
CID 62743796
methyl 2-(1-methoxycycloheptyl)-1H-imidazole-5-carboxylate
CID 116777800
[2-(4-methoxyoxan-4-yl)-1H-imidazol-5-yl]methanamine
CID 116779727
2-(1-methoxycyclobutyl)-1H-imidazole-5-carbaldehyde
CID 116734128
methyl 2-(1-methoxycyclohexyl)-6-oxo-1H-pyrimidine-5-carboxylate
CID 114213688
2-(1-methoxycyclohexyl)-1H-imidazole-5-carboxylic acid
CID 116777785

Frequently Asked Questions

What is the IUPAC name of N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine (CID 113432918) is N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine is COC1(c2ncc(CNC(C)(C)C)[nH]2)CCCC1.
What is the InChIKey of N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is BPLRZGXABYFHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-13(2,3)16-10-11-9-15-12(17-11)14(18-4)7-5-6-8-14/h9,16H,5-8,10H2,1-4H3,(H,15,17).
What are the key properties of N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine?
N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 251.37 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(1-methoxycyclopentyl)-1H-imidazol-5-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 113432918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).