N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine

C15H21N5 — CID 65231968

IUPACN-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine
SMILESc1cc(N2CCC(NCCc3cnc[nH]3)CC2)ccn1
InChIInChI=1S/C15H21N5/c1(14-11-17-12-19-14)8-18-13-4-9-20(10-5-13)15-2-6-16-7-3-15/h2-3,6-7,11-13,18H,1,4-5,8-10H2,(H,17,19)
InChIKeyGFIBCLOMMRFEAF-UHFFFAOYSA-N
MW271.37 g/mol
LogP1.61
Rot. Bonds5

About N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine

N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine (PubChem CID 65231968) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine
PubChem CID65231968
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC NameN-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine
SMILESc1cc(N2CCC(NCCc3cnc[nH]3)CC2)ccn1
InChIInChI=1S/C15H21N5/c1(14-11-17-12-19-14)8-18-13-4-9-20(10-5-13)15-2-6-16-7-3-15/h2-3,6-7,11-13,18H,1,4-5,8-10H2,(H,17,19)
InChIKeyGFIBCLOMMRFEAF-UHFFFAOYSA-N
XLogP1.61
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N'-(1-pyridin-4-ylpiperidin-4-yl)butane-1,4-diamine
CID 60895619
N-(3-ethoxypropyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166978
4-tert-butyl-N-[2-(1H-imidazol-5-yl)ethyl]cyclohexan-1-amine
CID 65230583
N-(cyclopropylmethyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166652
2-[(1-pyridin-4-ylpiperidin-4-yl)amino]ethylurea
CID 83110952
N'-ethyl-N'-methyl-N-(1-pyridin-4-ylpiperidin-4-yl)ethane-1,2-diamine
CID 55097459
2-[(1-pyridin-4-ylpiperidin-4-yl)amino]ethyl carbamate
CID 83210815
N-[(2-methylcyclopropyl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 113463722
N-[2-(1H-imidazol-5-yl)ethyl]-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658816
2-cyclohexyl-N-[2-(1H-imidazol-5-yl)ethyl]cyclohexan-1-amine
CID 65232162
N-[(1-methylpyrazol-4-yl)methyl]-1-pyridin-4-ylpiperidin-4-amine
CID 61351170
3-(3-fluorophenyl)-N-[2-(1H-imidazol-5-yl)ethyl]cyclobutan-1-amine
CID 65232395

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine?
The IUPAC name of N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine (CID 65231968) is N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine.
What is the SMILES notation for N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine?
The canonical SMILES for N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine is c1cc(N2CCC(NCCc3cnc[nH]3)CC2)ccn1.
What is the InChIKey of N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine?
The InChIKey is GFIBCLOMMRFEAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1(14-11-17-12-19-14)8-18-13-4-9-20(10-5-13)15-2-6-16-7-3-15/h2-3,6-7,11-13,18H,1,4-5,8-10H2,(H,17,19).
What are the key properties of N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine?
N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-imidazol-5-yl)ethyl]-1-pyridin-4-ylpiperidin-4-amine is sourced from PubChem (CID 65231968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).