N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide

C10H15N5O — CID 47937761

IUPACN-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide
SMILESO=C(NC1CCN(C2CC2)C1)c1cn[nH]n1
InChIInChI=1S/C10H15N5O/c16-10(9-5-11-14-13-9)12-7-3-4-15(6-7)8-1-2-8/h5,7-8H,1-4,6H2,(H,12,16)(H,11,13,14)
InChIKeyNBYGMQFBTMKLRG-UHFFFAOYSA-N
MW221.26 g/mol
LogP-0.23
Rot. Bonds3

About N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide

N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide (PubChem CID 47937761) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide
PubChem CID47937761
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC NameN-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide
SMILESO=C(NC1CCN(C2CC2)C1)c1cn[nH]n1
InChIInChI=1S/C10H15N5O/c16-10(9-5-11-14-13-9)12-7-3-4-15(6-7)8-1-2-8/h5,7-8H,1-4,6H2,(H,12,16)(H,11,13,14)
InChIKeyNBYGMQFBTMKLRG-UHFFFAOYSA-N
XLogP-0.23
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2H-triazole-4-carboxamide
CID 112733260
N-[(3S)-1-(cyclopropanecarbonyl)piperidin-3-yl]-2H-triazole-4-carboxamide
CID 125159540
N-(1-tert-butylpiperidin-4-yl)-2H-triazole-4-carboxamide
CID 112733890
5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 81317228
N-[[(3R)-1-cyclohexylpyrrolidin-3-yl]methyl]-2H-triazole-4-carboxamide
CID 125439680
5-(aminomethyl)-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 55231554
N-(1-cyclopropylpyrrolidin-3-yl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107374989
4-(2H-triazole-4-carbonylamino)cyclohexane-1-carboxylic acid
CID 63283411
N-(2-methylpiperidin-4-yl)-2H-triazole-4-carboxamide
CID 106995382
6-chloro-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 62233324
N-[(3S)-1-cyclopropylpyrrolidin-3-yl]-1-(4-fluorophenyl)triazole-4-carboxamide
CID 95293281
N-(4-ethylcyclohexyl)-2H-triazole-4-carboxamide
CID 112733318

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide?
The IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide (CID 47937761) is N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide?
The canonical SMILES for N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide is O=C(NC1CCN(C2CC2)C1)c1cn[nH]n1.
What is the InChIKey of N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide?
The InChIKey is NBYGMQFBTMKLRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c16-10(9-5-11-14-13-9)12-7-3-4-15(6-7)8-1-2-8/h5,7-8H,1-4,6H2,(H,12,16)(H,11,13,14).
What are the key properties of N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide?
N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide has a molecular weight of 221.26 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide is sourced from PubChem (CID 47937761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).