N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine

C14H26N4 — CID 66152169

IUPACN-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine
SMILESCC(C)NCc1cncn1CCN1CCCCC1
InChIInChI=1S/C14H26N4/c1-13(2)16-11-14-10-15-12-18(14)9-8-17-6-4-3-5-7-17/h10,12-13,16H,3-9,11H2,1-2H3
InChIKeyIIRJPHKCSDHKJO-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.87
Rot. Bonds6

About N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine

N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine (PubChem CID 66152169) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine
PubChem CID66152169
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine
SMILESCC(C)NCc1cncn1CCN1CCCCC1
InChIInChI=1S/C14H26N4/c1-13(2)16-11-14-10-15-12-18(14)9-8-17-6-4-3-5-7-17/h10,12-13,16H,3-9,11H2,1-2H3
InChIKeyIIRJPHKCSDHKJO-UHFFFAOYSA-N
XLogP1.87
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-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-[(3-ethylimidazol-4-yl)methyl]propan-2-amine
CID 66118230
2-methoxy-N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]ethanamine
CID 66151760
N-[[3-(2-cyclohexyloxyethyl)imidazol-4-yl]methyl]propan-2-amine
CID 66151207
N-[[3-(cyclohexylmethyl)imidazol-4-yl]methyl]propan-2-amine
CID 66147976
N-[[3-(3-methoxypropyl)imidazol-4-yl]methyl]propan-2-amine
CID 66146724
N-[[3-[(1-methylpiperidin-4-yl)methyl]imidazol-4-yl]methyl]propan-2-amine
CID 66150946
N-[[3-[2-(1-methylpyrazol-4-yl)ethyl]imidazol-4-yl]methyl]propan-2-amine
CID 80686896
N-[[1-(2-piperidin-1-ylethyl)pyrrol-2-yl]methyl]propan-2-amine
CID 66401991
4-[5-[(propan-2-ylamino)methyl]imidazol-1-yl]butanamide
CID 66146111
1-piperidin-1-yl-2-[(3-propylimidazol-4-yl)methylamino]propan-1-one
CID 66130168
3-(azocan-1-yl)-N-[[3-(2-methylpropyl)imidazol-4-yl]methyl]propanamide
CID 131916605
N-[[3-[2-(1-methylpyrazol-3-yl)ethyl]imidazol-4-yl]methyl]propan-2-amine
CID 106106680

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine (CID 66152169) is N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine is CC(C)NCc1cncn1CCN1CCCCC1.
What is the InChIKey of N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine?
The InChIKey is IIRJPHKCSDHKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-13(2)16-11-14-10-15-12-18(14)9-8-17-6-4-3-5-7-17/h10,12-13,16H,3-9,11H2,1-2H3.
What are the key properties of N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine?
N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-piperidin-1-ylethyl)imidazol-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 66152169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).