2-(propylamino)-4-pyrazol-1-ylbutanamide

C10H18N4O — CID 63039561

IUPAC2-(propylamino)-4-pyrazol-1-ylbutanamide
SMILESCCCNC(CCn1cccn1)C(N)=O
InChIInChI=1S/C10H18N4O/c1-2-5-12-9(10(11)15)4-8-14-7-3-6-13-14/h3,6-7,9,12H,2,4-5,8H2,1H3,(H2,11,15)
InChIKeyHVOCPSZNJWYXSC-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.13
Rot. Bonds7

About 2-(propylamino)-4-pyrazol-1-ylbutanamide

2-(propylamino)-4-pyrazol-1-ylbutanamide (PubChem CID 63039561) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-(propylamino)-4-pyrazol-1-ylbutanamide.

Molecular Properties

Compound Name2-(propylamino)-4-pyrazol-1-ylbutanamide
PubChem CID63039561
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-(propylamino)-4-pyrazol-1-ylbutanamide
SMILESCCCNC(CCn1cccn1)C(N)=O
InChIInChI=1S/C10H18N4O/c1-2-5-12-9(10(11)15)4-8-14-7-3-6-13-14/h3,6-7,9,12H,2,4-5,8H2,1H3,(H2,11,15)
InChIKeyHVOCPSZNJWYXSC-UHFFFAOYSA-N
XLogP0.13
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-(propan-2-ylamino)-4-pyrazol-1-ylbutanoate
CID 55144911
2-(2-pyrazol-1-ylethylamino)hexanoic acid
CID 103247140
methyl 2-(propan-2-ylamino)-4-pyrazol-1-ylbutanoate
CID 63040313
N-propyl-2-(3-pyrazol-1-ylpropylamino)propanamide
CID 113223084
3-(2-pyrazol-1-ylethylamino)butanamide
CID 115676497
4-(2,5-dioxopyrrolidin-1-yl)-2-(propylamino)butanamide
CID 63041647
2-(propylamino)nonanamide
CID 60796532
2-(propylamino)octanamide
CID 60795649
N-(2-pyrazol-1-ylethyl)heptan-4-amine
CID 61460010
ethyl 4-(4-chloropyrazol-1-yl)-2-(propylamino)butanoate
CID 63040126
4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide
CID 63053485
N-pentyl-2-(2-pyrazol-1-ylethylamino)propanamide
CID 54951591

Frequently Asked Questions

What is the IUPAC name of 2-(propylamino)-4-pyrazol-1-ylbutanamide?
The IUPAC name of 2-(propylamino)-4-pyrazol-1-ylbutanamide (CID 63039561) is 2-(propylamino)-4-pyrazol-1-ylbutanamide.
What is the SMILES notation for 2-(propylamino)-4-pyrazol-1-ylbutanamide?
The canonical SMILES for 2-(propylamino)-4-pyrazol-1-ylbutanamide is CCCNC(CCn1cccn1)C(N)=O.
What is the InChIKey of 2-(propylamino)-4-pyrazol-1-ylbutanamide?
The InChIKey is HVOCPSZNJWYXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-2-5-12-9(10(11)15)4-8-14-7-3-6-13-14/h3,6-7,9,12H,2,4-5,8H2,1H3,(H2,11,15).
What are the key properties of 2-(propylamino)-4-pyrazol-1-ylbutanamide?
2-(propylamino)-4-pyrazol-1-ylbutanamide has a molecular weight of 210.28 g/mol, XLogP of 0.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propylamino)-4-pyrazol-1-ylbutanamide is sourced from PubChem (CID 63039561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).