2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide

C14H22N4O — CID 62069655

IUPAC2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide
SMILESO=C(Cn1cc(NCC2CCCC2)cn1)NC1CC1
InChIInChI=1S/C14H22N4O/c19-14(17-12-5-6-12)10-18-9-13(8-16-18)15-7-11-3-1-2-4-11/h8-9,11-12,15H,1-7,10H2,(H,17,19)
InChIKeyAGGLKHGIZRATOR-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.76
Rot. Bonds6

About 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide

2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide (PubChem CID 62069655) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide
PubChem CID62069655
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide
SMILESO=C(Cn1cc(NCC2CCCC2)cn1)NC1CC1
InChIInChI=1S/C14H22N4O/c19-14(17-12-5-6-12)10-18-9-13(8-16-18)15-7-11-3-1-2-4-11/h8-9,11-12,15H,1-7,10H2,(H,17,19)
InChIKeyAGGLKHGIZRATOR-UHFFFAOYSA-N
XLogP1.76
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide?
The IUPAC name of 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide (CID 62069655) is 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide?
The canonical SMILES for 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide is O=C(Cn1cc(NCC2CCCC2)cn1)NC1CC1.
What is the InChIKey of 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide?
The InChIKey is AGGLKHGIZRATOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c19-14(17-12-5-6-12)10-18-9-13(8-16-18)15-7-11-3-1-2-4-11/h8-9,11-12,15H,1-7,10H2,(H,17,19).
What are the key properties of 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide?
2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide has a molecular weight of 262.36 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopentylmethylamino)pyrazol-1-yl]-N-cyclopropylacetamide is sourced from PubChem (CID 62069655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).