N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide

C9H12N4O — CID 763137

IUPACN-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide
SMILESO=C(NN=C1CCCC1)c1ccn[nH]1
InChIInChI=1S/C9H12N4O/c14-9(8-5-6-10-12-8)13-11-7-3-1-2-4-7/h5-6H,1-4H2,(H,10,12)(H,13,14)
InChIKeySUIOHJHTZSICPD-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.07
Rot. Bonds2

About N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide

N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide (PubChem CID 763137) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide
PubChem CID763137
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC NameN-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide
SMILESO=C(NN=C1CCCC1)c1ccn[nH]1
InChIInChI=1S/C9H12N4O/c14-9(8-5-6-10-12-8)13-11-7-3-1-2-4-7/h5-6H,1-4H2,(H,10,12)(H,13,14)
InChIKeySUIOHJHTZSICPD-UHFFFAOYSA-N
XLogP1.07
TPSA70.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1H-pyrazole-3-carbaldehyde
CID 12218383
1H-pyrazole-5-carbohydrazide
CID 7147494
1H-Pyrazole-5-carboxamide
CID 15239624
n-Methyl-1h-pyrazole-3-carboxamide
CID 19704574
N~3~-isobutyl-1H-pyrazole-3-carboxamide
CID 53017403
N'-propan-2-yl-1H-pyrazole-5-carbohydrazide
CID 90679861
Amino-1h-pyrazolecarboxamide
CID 15152502
N-tert-Butyl-1H-pyrazole-5-carboxamide
CID 23279698
Ethane-1,2-diamine, N,N'-bis(3-pyrazolylcarbonyl)-
CID 565685
N-(2-aminoethyl)-1H-pyrazole-5-carboxamide hydrochloride
CID 71758320
N-(2-methylpentan-2-yl)-1H-pyrazole-3-carboxamide
CID 53538100
N,N-diethyl-1H-pyrazole-3-carboxamide
CID 5128709

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide (CID 763137) is N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide is O=C(NN=C1CCCC1)c1ccn[nH]1.
What is the InChIKey of N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide?
The InChIKey is SUIOHJHTZSICPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c14-9(8-5-6-10-12-8)13-11-7-3-1-2-4-7/h5-6H,1-4H2,(H,10,12)(H,13,14).
What are the key properties of N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide?
N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide has a molecular weight of 192.22 g/mol, XLogP of 1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylideneamino)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 763137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).