(2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide

C19H25N7O — CID 175738232

IUPAC(2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide
SMILESC[C@@H](Nc1nc2ccccc2c2cnnn12)C(=O)NCCN1CCCCC1
InChIInChI=1S/C19H25N7O/c1-14(18(27)20-9-12-25-10-5-2-6-11-25)22-19-23-16-8-4-3-7-15(16)17-13-21-24-26(17)19/h3-4,7-8,13-14H,2,5-6,9-12H2,1H3,(H,20,27)(H,22,23)/t14-/m1/s1
InChIKeyWBNFTWXQGSVMIC-CQSZACIVSA-N
MW367.46 g/mol
LogP1.68
Rot. Bonds6

About (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide

(2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide (PubChem CID 175738232) has the molecular formula C19H25N7O and a molecular weight of 367.46 g/mol. Its IUPAC name is (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide
PubChem CID175738232
Molecular FormulaC19H25N7O
Molecular Weight367.46 g/mol
Exact Mass367.21
IUPAC Name(2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide
SMILESC[C@@H](Nc1nc2ccccc2c2cnnn12)C(=O)NCCN1CCCCC1
InChIInChI=1S/C19H25N7O/c1-14(18(27)20-9-12-25-10-5-2-6-11-25)22-19-23-16-8-4-3-7-15(16)17-13-21-24-26(17)19/h3-4,7-8,13-14H,2,5-6,9-12H2,1H3,(H,20,27)(H,22,23)/t14-/m1/s1
InChIKeyWBNFTWXQGSVMIC-CQSZACIVSA-N
XLogP1.68
TPSA87.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.46
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-amino-2-phenyl-N-(2-piperidin-1-ylethyl)propanamide
CID 62878557
N-[2-(azepan-1-yl)ethyl]-2-methylquinoline-4-carboxamide
CID 46291441
N-[2-(azepan-1-yl)ethyl]-2-phenoxypropanamide
CID 86929905
(2S)-3-(4-hydroxyphenyl)-2-phenyl-N-(2-piperidin-1-ylethyl)propanamide
CID 97445107
N-(2-piperidin-1-ylethyl)acridin-9-amine
CID 4976664
2-[(5-benzyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(2-piperidin-1-ylethyl)propanamide
CID 6411372
2-(3,4-dimethylphenyl)-N-(2-piperidin-1-ylethyl)quinoline-4-carboxamide
CID 42749415
2-(benzotriazol-1-yl)-N-(2-piperidin-1-ylethyl)acetamide
CID 10379321
2-(2-fluorophenyl)-N-(2-piperidin-1-ylethyl)quinoline-4-carboxamide
CID 42749525
3-(1-methylindol-3-yl)-N-(2-piperidin-1-ylethyl)-3-thiophen-2-ylpropanamide
CID 42778058
2-oxo-N-(2-piperidin-1-ylethyl)-2-(1-propan-2-ylpyrrolo[2,3-b]pyridin-3-yl)acetamide
CID 46222156
N-(2-piperidin-1-ylethyl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 42749438

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide?
The IUPAC name of (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide (CID 175738232) is (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide.
What is the SMILES notation for (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide?
The canonical SMILES for (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide is C[C@@H](Nc1nc2ccccc2c2cnnn12)C(=O)NCCN1CCCCC1.
What is the InChIKey of (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide?
The InChIKey is WBNFTWXQGSVMIC-CQSZACIVSA-N. The full InChI is InChI=1S/C19H25N7O/c1-14(18(27)20-9-12-25-10-5-2-6-11-25)22-19-23-16-8-4-3-7-15(16)17-13-21-24-26(17)19/h3-4,7-8,13-14H,2,5-6,9-12H2,1H3,(H,20,27)(H,22,23)/t14-/m1/s1.
What are the key properties of (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide?
(2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide has a molecular weight of 367.46 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide is sourced from PubChem (CID 175738232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).