N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine

C18H26N4 — CID 120835453

IUPACN-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCN(Cc1nccn1-c1ccccc1)C1CCNCC1
InChIInChI=1S/C18H26N4/c1-2-13-21(16-8-10-19-11-9-16)15-18-20-12-14-22(18)17-6-4-3-5-7-17/h3-7,12,14,16,19H,2,8-11,13,15H2,1H3
InChIKeyGWOLFVUKYVICBX-UHFFFAOYSA-N
MW298.43 g/mol
LogP2.84
Rot. Bonds6

About N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine

N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine (PubChem CID 120835453) has the molecular formula C18H26N4 and a molecular weight of 298.43 g/mol. Its IUPAC name is N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine
PubChem CID120835453
Molecular FormulaC18H26N4
Molecular Weight298.43 g/mol
Exact Mass298.22
IUPAC NameN-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCN(Cc1nccn1-c1ccccc1)C1CCNCC1
InChIInChI=1S/C18H26N4/c1-2-13-21(16-8-10-19-11-9-16)15-18-20-12-14-22(18)17-6-4-3-5-7-17/h3-7,12,14,16,19H,2,8-11,13,15H2,1H3
InChIKeyGWOLFVUKYVICBX-UHFFFAOYSA-N
XLogP2.84
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-N-propylpiperidin-4-amine;dihydrochloride
CID 119933016
N-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
CID 112650950
N-[(2-bromophenyl)methyl]-N-propylpiperidin-4-amine
CID 54923407
N-(2-phenoxyethyl)-N-propylpiperidin-4-amine
CID 60807688
2-[methyl-[(1-phenylimidazol-2-yl)methyl]amino]-1-piperazin-1-ylethanone
CID 120835873
N-benzyl-N-propylpyrrolidin-3-amine;hydrochloride
CID 119921759
N-propyl-N-(2-pyrazol-1-ylethyl)piperidin-4-amine
CID 54960820
N-[(5-bromo-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
CID 115741636
N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine
CID 60806152
1-phenyl-2-[piperidin-4-yl(propyl)amino]ethanone
CID 62031069
N-[(3,4-dichlorophenyl)methyl]-N-propylpiperidin-4-amine
CID 60806819
4-[[piperidin-4-yl(propyl)amino]methyl]pyridine-2-carbonitrile
CID 63880798

Frequently Asked Questions

What is the IUPAC name of N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine?
The IUPAC name of N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine (CID 120835453) is N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine.
What is the SMILES notation for N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine?
The canonical SMILES for N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine is CCCN(Cc1nccn1-c1ccccc1)C1CCNCC1.
What is the InChIKey of N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine?
The InChIKey is GWOLFVUKYVICBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4/c1-2-13-21(16-8-10-19-11-9-16)15-18-20-12-14-22(18)17-6-4-3-5-7-17/h3-7,12,14,16,19H,2,8-11,13,15H2,1H3.
What are the key properties of N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine?
N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine has a molecular weight of 298.43 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-phenylimidazol-2-yl)methyl]-N-propylpiperidin-4-amine is sourced from PubChem (CID 120835453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).