N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide

C31H32N4O — CID 26335398

IUPACN-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1cccc(N2CCC(NCC(c3ccccc3)c3ccccc3)CC2)c1)c1ccncc1
InChIInChI=1S/C31H32N4O/c36-31(26-14-18-32-19-15-26)34-28-12-7-13-29(22-28)35-20-16-27(17-21-35)33-23-30(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-15,18-19,22,27,30,33H,16-17,20-21,23H2,(H,34,36)
InChIKeyRLPWWMSTGWSFNQ-UHFFFAOYSA-N
MW476.62 g/mol
LogP5.72
Rot. Bonds8

About N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide

N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide (PubChem CID 26335398) has the molecular formula C31H32N4O and a molecular weight of 476.62 g/mol. Its IUPAC name is N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide
PubChem CID26335398
Molecular FormulaC31H32N4O
Molecular Weight476.62 g/mol
Exact Mass476.26
IUPAC NameN-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide
SMILESO=C(Nc1cccc(N2CCC(NCC(c3ccccc3)c3ccccc3)CC2)c1)c1ccncc1
InChIInChI=1S/C31H32N4O/c36-31(26-14-18-32-19-15-26)34-28-12-7-13-29(22-28)35-20-16-27(17-21-35)33-23-30(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-15,18-19,22,27,30,33H,16-17,20-21,23H2,(H,34,36)
InChIKeyRLPWWMSTGWSFNQ-UHFFFAOYSA-N
XLogP5.72
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.62
LogP ≤ 55.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide 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-[4-[[4-(trifluoromethyl)phenyl]methylamino]piperidin-1-yl]phenyl]pyridine-4-carboxamide
CID 42433832
N-[3-[4-[2-[2-(trifluoromethyl)phenyl]ethylamino]piperidin-1-yl]phenyl]pyridine-4-carboxamide
CID 42405845
N-[3-[4-[[(2S)-2-(4-fluorophenyl)-2-pyrrolidin-1-ylethyl]amino]piperidin-1-yl]phenyl]pyridine-3-carboxamide
CID 125159053
N-[3-[4-(thiophen-2-ylmethylamino)piperidin-1-yl]phenyl]pyridine-3-carboxamide
CID 25294297
N-[3-[4-(1-thiophen-2-ylethylamino)piperidin-1-yl]phenyl]pyridine-3-carboxamide
CID 45201861
N-[3-[4-(3-pyridin-4-ylpropylamino)piperidin-1-yl]phenyl]-3-(trifluoromethyl)benzamide
CID 25294988
N-[3-[4-[[(1S)-1-(6-methyl-1H-benzimidazol-2-yl)ethyl]amino]piperidin-1-yl]phenyl]pyridine-4-carboxamide
CID 125179634
N-[3-[[(2R)-2-hydroxy-2-phenylacetyl]amino]phenyl]pyridine-4-carboxamide
CID 122132708
N-[1-(2,2-diphenylacetyl)piperidin-4-yl]pyridine-4-carboxamide
CID 108556851
3-[1-hydroxy-2-[(1-phenylpiperidin-4-yl)amino]ethyl]phenol
CID 91038592
N-[3-[4-(1,3-benzothiazol-2-ylmethylamino)piperidin-1-yl]phenyl]cyclopropanecarboxamide
CID 26401273
N-(3-morpholin-4-ylphenyl)-2-phenyl-3-pyridin-4-ylpropanamide
CID 110612953

Frequently Asked Questions

What is the IUPAC name of N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide?
The IUPAC name of N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide (CID 26335398) is N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide is O=C(Nc1cccc(N2CCC(NCC(c3ccccc3)c3ccccc3)CC2)c1)c1ccncc1.
What is the InChIKey of N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide?
The InChIKey is RLPWWMSTGWSFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32N4O/c36-31(26-14-18-32-19-15-26)34-28-12-7-13-29(22-28)35-20-16-27(17-21-35)33-23-30(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-15,18-19,22,27,30,33H,16-17,20-21,23H2,(H,34,36).
What are the key properties of N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide?
N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide has a molecular weight of 476.62 g/mol, XLogP of 5.72, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[4-(2,2-diphenylethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 26335398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).