5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide

C10H15N5O2 — CID 79400745

IUPAC5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide
SMILESNc1[nH]ncc1C(=O)NCCC(=O)NC1CC1
InChIInChI=1S/C10H15N5O2/c11-9-7(5-13-15-9)10(17)12-4-3-8(16)14-6-1-2-6/h5-6H,1-4H2,(H,12,17)(H,14,16)(H3,11,13,15)
InChIKeyBARYXQWEJRSXEI-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.61
Rot. Bonds5

About 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide

5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide (PubChem CID 79400745) has the molecular formula C10H15N5O2 and a molecular weight of 237.26 g/mol. Its IUPAC name is 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide
PubChem CID79400745
Molecular FormulaC10H15N5O2
Molecular Weight237.26 g/mol
Exact Mass237.12
IUPAC Name5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide
SMILESNc1[nH]ncc1C(=O)NCCC(=O)NC1CC1
InChIInChI=1S/C10H15N5O2/c11-9-7(5-13-15-9)10(17)12-4-3-8(16)14-6-1-2-6/h5-6H,1-4H2,(H,12,17)(H,14,16)(H3,11,13,15)
InChIKeyBARYXQWEJRSXEI-UHFFFAOYSA-N
XLogP-0.61
TPSA112.90 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 60920304
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5-amino-N-(2-cyclohexylethyl)-1H-pyrazole-4-carboxamide
CID 54932334
5-amino-N-(2-chloroethyl)-1H-pyrazole-4-carboxamide
CID 123588221
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CID 63361518
5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-2,4-dimethylbenzamide
CID 102705738
4-amino-N-[4-(cyclopropylamino)-4-oxobutyl]pyridine-3-carboxamide
CID 81245479
5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-2-fluorobenzamide
CID 79386437
2-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-4-fluorobenzamide
CID 79400649
N-[3-(cyclopropylamino)-3-oxopropyl]-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81249567
5-amino-N-[2-(trifluoromethylsulfanyl)ethyl]-1H-pyrazole-4-carboxamide
CID 106432190

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide (CID 79400745) is 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide is Nc1[nH]ncc1C(=O)NCCC(=O)NC1CC1.
What is the InChIKey of 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide?
The InChIKey is BARYXQWEJRSXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2/c11-9-7(5-13-15-9)10(17)12-4-3-8(16)14-6-1-2-6/h5-6H,1-4H2,(H,12,17)(H,14,16)(H3,11,13,15).
What are the key properties of 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide?
5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide has a molecular weight of 237.26 g/mol, XLogP of -0.61, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 79400745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).