N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide

C22H29N5O — CID 110237820

IUPACN-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide
SMILESCC1(C)Cc2nc(-c3cccnc3)ncc2C(NC(=O)CN2CCCCC2)C1
InChIInChI=1S/C22H29N5O/c1-22(2)11-18(25-20(28)15-27-9-4-3-5-10-27)17-14-24-21(26-19(17)12-22)16-7-6-8-23-13-16/h6-8,13-14,18H,3-5,9-12,15H2,1-2H3,(H,25,28)
InChIKeyVVLGWGRJDQELMN-UHFFFAOYSA-N
MW379.51 g/mol
LogP3.15
Rot. Bonds4

About N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide

N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide (PubChem CID 110237820) has the molecular formula C22H29N5O and a molecular weight of 379.51 g/mol. Its IUPAC name is N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide
PubChem CID110237820
Molecular FormulaC22H29N5O
Molecular Weight379.51 g/mol
Exact Mass379.24
IUPAC NameN-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide
SMILESCC1(C)Cc2nc(-c3cccnc3)ncc2C(NC(=O)CN2CCCCC2)C1
InChIInChI=1S/C22H29N5O/c1-22(2)11-18(25-20(28)15-27-9-4-3-5-10-27)17-14-24-21(26-19(17)12-22)16-7-6-8-23-13-16/h6-8,13-14,18H,3-5,9-12,15H2,1-2H3,(H,25,28)
InChIKeyVVLGWGRJDQELMN-UHFFFAOYSA-N
XLogP3.15
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.51
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide with MolForge

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Related Compounds

N,7,7-trimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-amine
CID 62009705
2-(2-oxoazepan-1-yl)-N-[(5R)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
CID 97131151
N-(7,7-dimethyl-2-pyridin-4-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-(2-oxopyrrolidin-1-yl)butanamide
CID 46955296
N-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]cyclobutanecarboxamide
CID 25379238
N-(7,7-dimethyl-2-pyrrolidin-1-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-(3-methoxyphenyl)acetamide
CID 110237895
N-(7,7-dimethyl-2-pyridin-4-yl-6,8-dihydro-5H-quinazolin-5-yl)-4,5-dimethylthiophene-2-carboxamide
CID 110237676
N-(7,7-dimethyl-2-pyridin-4-yl-6,8-dihydro-5H-quinazolin-5-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 110237660
2-(2-hydroxyphenoxy)-N-(2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl)acetamide
CID 72852912
3-(furan-2-yl)-N-(2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide
CID 56731447
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(7,7-dimethyl-2-pyrazin-2-yl-6,8-dihydro-5H-quinazolin-5-yl)acetamide
CID 110238924
N-(2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl)-3-thiophen-2-ylpropanamide
CID 45235406
2-chloro-N-[(5R)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]benzamide
CID 51589334

Frequently Asked Questions

What is the IUPAC name of N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide?
The IUPAC name of N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide (CID 110237820) is N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide is CC1(C)Cc2nc(-c3cccnc3)ncc2C(NC(=O)CN2CCCCC2)C1.
What is the InChIKey of N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide?
The InChIKey is VVLGWGRJDQELMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N5O/c1-22(2)11-18(25-20(28)15-27-9-4-3-5-10-27)17-14-24-21(26-19(17)12-22)16-7-6-8-23-13-16/h6-8,13-14,18H,3-5,9-12,15H2,1-2H3,(H,25,28).
What are the key properties of N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide?
N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide has a molecular weight of 379.51 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7,7-dimethyl-2-pyridin-3-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-piperidin-1-ylacetamide is sourced from PubChem (CID 110237820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).