(2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide

C14H16N6O — CID 175738418

IUPAC(2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide
SMILESCCC[C@@H](Nc1nc2ccccc2c2cnnn12)C(N)=O
InChIInChI=1S/C14H16N6O/c1-2-5-11(13(15)21)18-14-17-10-7-4-3-6-9(10)12-8-16-19-20(12)14/h3-4,6-8,11H,2,5H2,1H3,(H2,15,21)(H,17,18)/t11-/m1/s1
InChIKeyNVDKDHXRQJJUGE-LLVKDONJSA-N
MW284.32 g/mol
LogP1.34
Rot. Bonds5

About (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide

(2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide (PubChem CID 175738418) has the molecular formula C14H16N6O and a molecular weight of 284.32 g/mol. Its IUPAC name is (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide.

Molecular Properties

Compound Name(2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide
PubChem CID175738418
Molecular FormulaC14H16N6O
Molecular Weight284.32 g/mol
Exact Mass284.14
IUPAC Name(2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide
SMILESCCC[C@@H](Nc1nc2ccccc2c2cnnn12)C(N)=O
InChIInChI=1S/C14H16N6O/c1-2-5-11(13(15)21)18-14-17-10-7-4-3-6-9(10)12-8-16-19-20(12)14/h3-4,6-8,11H,2,5H2,1H3,(H2,15,21)(H,17,18)/t11-/m1/s1
InChIKeyNVDKDHXRQJJUGE-LLVKDONJSA-N
XLogP1.34
TPSA98.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-N-(2-piperidin-1-ylethyl)-2-(triazolo[1,5-c]quinazolin-5-ylamino)propanamide
CID 175738232
(2R)-2-[[2-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]amino]butanamide
CID 156637192
2-[(4-carbamoylquinolin-2-yl)amino]pentanoic acid
CID 63886576
2-[(2-chloroquinazolin-4-yl)amino]pentanoic acid
CID 22693080
2-[(2-methylquinolin-4-yl)amino]pentanoic acid
CID 43631351
2-[[4-(methylamino)quinazolin-2-yl]amino]pentanoic acid
CID 122060479
2-anilinoheptanamide
CID 61005049
2-(quinazolin-4-ylamino)pentanoic acid
CID 3356607
2-[[2-(pyrrolidin-1-ylmethyl)quinazolin-4-yl]amino]pentanoic acid
CID 21004110
2-[(4-methylphthalazin-1-yl)amino]pentanoic acid
CID 43631341
2-(3-bromoanilino)pentanamide
CID 61005208
(2S)-2-anilinopentanoic acid
CID 22847649

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide?
The IUPAC name of (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide (CID 175738418) is (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide.
What is the SMILES notation for (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide?
The canonical SMILES for (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide is CCC[C@@H](Nc1nc2ccccc2c2cnnn12)C(N)=O.
What is the InChIKey of (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide?
The InChIKey is NVDKDHXRQJJUGE-LLVKDONJSA-N. The full InChI is InChI=1S/C14H16N6O/c1-2-5-11(13(15)21)18-14-17-10-7-4-3-6-9(10)12-8-16-19-20(12)14/h3-4,6-8,11H,2,5H2,1H3,(H2,15,21)(H,17,18)/t11-/m1/s1.
What are the key properties of (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide?
(2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide has a molecular weight of 284.32 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(triazolo[1,5-c]quinazolin-5-ylamino)pentanamide is sourced from PubChem (CID 175738418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).