N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine

C20H23N5 — CID 71884718

IUPACN-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine
SMILESCC(C)N1CCC(Nc2nc(-c3ccncc3)nc3ccccc23)C1
InChIInChI=1S/C20H23N5/c1-14(2)25-12-9-16(13-25)22-20-17-5-3-4-6-18(17)23-19(24-20)15-7-10-21-11-8-15/h3-8,10-11,14,16H,9,12-13H2,1-2H3,(H,22,23,24)
InChIKeyWYGUTZGLMJWNBO-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.59
Rot. Bonds4

About N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine

N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine (PubChem CID 71884718) has the molecular formula C20H23N5 and a molecular weight of 333.44 g/mol. Its IUPAC name is N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine
PubChem CID71884718
Molecular FormulaC20H23N5
Molecular Weight333.44 g/mol
Exact Mass333.20
IUPAC NameN-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine
SMILESCC(C)N1CCC(Nc2nc(-c3ccncc3)nc3ccccc23)C1
InChIInChI=1S/C20H23N5/c1-14(2)25-12-9-16(13-25)22-20-17-5-3-4-6-18(17)23-19(24-20)15-7-10-21-11-8-15/h3-8,10-11,14,16H,9,12-13H2,1-2H3,(H,22,23,24)
InChIKeyWYGUTZGLMJWNBO-UHFFFAOYSA-N
XLogP3.59
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridin-4-ylquinazolin-4-amine
CID 133281755
tert-butyl 4-[(2-pyridin-4-ylquinazolin-4-yl)amino]piperidine-1-carboxylate
CID 58919641
N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine
CID 166205965
[(3S)-3-[(2-phenylquinazolin-4-yl)amino]pyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 97016537
6-[4-[(2-pyridin-4-ylquinazolin-4-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 133286769
5-[(2-pyridin-4-ylquinazolin-4-yl)amino]-2,3,3a,4,5,6,7,7a-octahydro-1H-indazole-3-carboxamide
CID 133406969
N-[(1R,2R,3R)-3-ethoxy-2-methoxycyclobutyl]-2-pyridin-4-ylquinazolin-4-amine
CID 124737313
N-[(3R)-2-methylpentan-3-yl]-2-pyridin-4-ylquinazolin-4-amine
CID 59389582
1-N,1-N-dimethyl-3-N-(2-pyridin-4-ylquinazolin-4-yl)butane-1,3-diamine
CID 133276695
N-[1-(2-pyridin-4-ylquinazolin-4-yl)piperidin-4-yl]acetamide
CID 49431018
2-chloro-N-(1-methylpyrrolidin-3-yl)quinazolin-4-amine
CID 62477526
N-(2,2-diphenylethyl)-2-pyridin-4-ylquinazolin-4-amine
CID 121377208

Frequently Asked Questions

What is the IUPAC name of N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
The IUPAC name of N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine (CID 71884718) is N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine.
What is the SMILES notation for N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
The canonical SMILES for N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine is CC(C)N1CCC(Nc2nc(-c3ccncc3)nc3ccccc23)C1.
What is the InChIKey of N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
The InChIKey is WYGUTZGLMJWNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5/c1-14(2)25-12-9-16(13-25)22-20-17-5-3-4-6-18(17)23-19(24-20)15-7-10-21-11-8-15/h3-8,10-11,14,16H,9,12-13H2,1-2H3,(H,22,23,24).
What are the key properties of N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine has a molecular weight of 333.44 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-ylquinazolin-4-amine is sourced from PubChem (CID 71884718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).