N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

C11H13N5O — CID 821801

IUPACN-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESO=C(NC1CCCC1)c1nc2ncccn2n1
InChIInChI=1S/C11H13N5O/c17-10(13-8-4-1-2-5-8)9-14-11-12-6-3-7-16(11)15-9/h3,6-8H,1-2,4-5H2,(H,13,17)
InChIKeyBFVRDENRZPYDPM-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.80
Rot. Bonds2

About N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 821801) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID821801
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC NameN-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESO=C(NC1CCCC1)c1nc2ncccn2n1
InChIInChI=1S/C11H13N5O/c17-10(13-8-4-1-2-5-8)9-14-11-12-6-3-7-16(11)15-9/h3,6-8H,1-2,4-5H2,(H,13,17)
InChIKeyBFVRDENRZPYDPM-UHFFFAOYSA-N
XLogP0.80
TPSA72.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-bromo-N-propyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 650648
N-cycloheptyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 644513
6-bromo-N-butyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2058779
N-pyrazolo[1,5-a]pyrimidin-3-ylacetamide
CID 172825317
N-pyrazolo[1,5-a]pyrimidin-3-ylpyrrolidine-1-carboxamide
CID 176141987
N-(cyclopropylmethyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 34831861
1-(3-Pyrazol-1-ylpiperidin-1-yl)-4-(pyrimidin-2-ylamino)butan-1-one
CID 53550834
1-(3-Pyrazol-1-ylpiperidin-1-yl)-3-(pyrimidin-2-ylamino)propan-1-one
CID 53551193
1-[3-(3,5-Dimethyl-1,2,4-triazol-1-yl)piperidin-1-yl]-4-(pyrimidin-2-ylamino)butan-1-one
CID 72142769
4-(Pyrimidin-2-ylamino)-1-[3-(1,2,4-triazol-1-yl)piperidin-1-yl]butan-1-one
CID 72143064
[([1,2,4]Triazolo[1,5-a]pyrimidine-2-carbonyl)-amino]-acetic acid
CID 842627
ethyl N-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylcarbonyl)glycinate
CID 4299604

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (CID 821801) is N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is O=C(NC1CCCC1)c1nc2ncccn2n1.
What is the InChIKey of N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is BFVRDENRZPYDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c17-10(13-8-4-1-2-5-8)9-14-11-12-6-3-7-16(11)15-9/h3,6-8H,1-2,4-5H2,(H,13,17).
What are the key properties of N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 231.26 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 821801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).