N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide

C10H18N4O — CID 62921299

IUPACN-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide
SMILESCCC(CCN)NC(=O)c1ccnn1C
InChIInChI=1S/C10H18N4O/c1-3-8(4-6-11)13-10(15)9-5-7-12-14(9)2/h5,7-8H,3-4,6,11H2,1-2H3,(H,13,15)
InChIKeyWTQDAUHVIQEZNV-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.28
Rot. Bonds5

About N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide

N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide (PubChem CID 62921299) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide
PubChem CID62921299
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide
SMILESCCC(CCN)NC(=O)c1ccnn1C
InChIInChI=1S/C10H18N4O/c1-3-8(4-6-11)13-10(15)9-5-7-12-14(9)2/h5,7-8H,3-4,6,11H2,1-2H3,(H,13,15)
InChIKeyWTQDAUHVIQEZNV-UHFFFAOYSA-N
XLogP0.28
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide?
The IUPAC name of N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide (CID 62921299) is N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide.
What is the SMILES notation for N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide?
The canonical SMILES for N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide is CCC(CCN)NC(=O)c1ccnn1C.
What is the InChIKey of N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide?
The InChIKey is WTQDAUHVIQEZNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-3-8(4-6-11)13-10(15)9-5-7-12-14(9)2/h5,7-8H,3-4,6,11H2,1-2H3,(H,13,15).
What are the key properties of N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide?
N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopentan-3-yl)-2-methylpyrazole-3-carboxamide is sourced from PubChem (CID 62921299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).