N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine

C24H23N5 — CID 133363141

IUPACN-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine
SMILESc1ccc(NC2CCCN(c3nc(-c4cccnc4)nc4ccccc34)C2)cc1
InChIInChI=1S/C24H23N5/c1-2-9-19(10-3-1)26-20-11-7-15-29(17-20)24-21-12-4-5-13-22(21)27-23(28-24)18-8-6-14-25-16-18/h1-6,8-10,12-14,16,20,26H,7,11,15,17H2
InChIKeyKORDMCGTZQNXNM-UHFFFAOYSA-N
MW381.48 g/mol
LogP4.77
Rot. Bonds4

About N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine

N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine (PubChem CID 133363141) has the molecular formula C24H23N5 and a molecular weight of 381.48 g/mol. Its IUPAC name is N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine
PubChem CID133363141
Molecular FormulaC24H23N5
Molecular Weight381.48 g/mol
Exact Mass381.20
IUPAC NameN-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine
SMILESc1ccc(NC2CCCN(c3nc(-c4cccnc4)nc4ccccc34)C2)cc1
InChIInChI=1S/C24H23N5/c1-2-9-19(10-3-1)26-20-11-7-15-29(17-20)24-21-12-4-5-13-22(21)27-23(28-24)18-8-6-14-25-16-18/h1-6,8-10,12-14,16,20,26H,7,11,15,17H2
InChIKeyKORDMCGTZQNXNM-UHFFFAOYSA-N
XLogP4.77
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-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

2-pyridin-3-yl-4-[(3S)-3-(trifluoromethyl)piperidin-1-yl]quinazoline
CID 2540547
4-(3-phenoxypyrrolidin-1-yl)-2-pyridin-3-ylquinazoline
CID 137470060
4-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-2-pyridin-3-ylquinazoline
CID 133322897
N-cyclopentyl-2-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]propanamide
CID 133287736
4-(2-pyridin-3-ylquinazolin-4-yl)-1,4-thiazinane 1,1-dioxide
CID 133287442
1-(2-pyridin-4-ylquinazolin-4-yl)piperidin-3-ol
CID 11415528
phenyl-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]methanone
CID 2480686
3-phenyl-5-[1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-4-yl]-1,2,4-oxadiazole
CID 133299396
2-(2-chlorophenyl)-4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
CID 133289876
(3S)-N-phenyl-1-pyrimidin-2-ylpiperidin-3-amine
CID 97226290
2-pyridin-4-yl-4-pyrrolidin-1-ylquinazoline
CID 659763
4-(3-phenyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-pyridin-3-ylquinazoline
CID 133327764

Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine?
The IUPAC name of N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine (CID 133363141) is N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine.
What is the SMILES notation for N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine?
The canonical SMILES for N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine is c1ccc(NC2CCCN(c3nc(-c4cccnc4)nc4ccccc34)C2)cc1.
What is the InChIKey of N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine?
The InChIKey is KORDMCGTZQNXNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5/c1-2-9-19(10-3-1)26-20-11-7-15-29(17-20)24-21-12-4-5-13-22(21)27-23(28-24)18-8-6-14-25-16-18/h1-6,8-10,12-14,16,20,26H,7,11,15,17H2.
What are the key properties of N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine?
N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine has a molecular weight of 381.48 g/mol, XLogP of 4.77, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-amine is sourced from PubChem (CID 133363141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).