2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide

C10H17N5O2 — CID 61393913

IUPAC2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide
SMILESCCC(C)C(NC(N)=O)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C10H17N5O2/c1-3-6(2)8(14-10(11)17)9(16)13-7-4-5-12-15-7/h4-6,8H,3H2,1-2H3,(H3,11,14,17)(H2,12,13,15,16)
InChIKeyFPQGDUNBGUCLLI-UHFFFAOYSA-N
MW239.28 g/mol
LogP0.43
Rot. Bonds5

About 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide

2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide (PubChem CID 61393913) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide
PubChem CID61393913
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide
SMILESCCC(C)C(NC(N)=O)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C10H17N5O2/c1-3-6(2)8(14-10(11)17)9(16)13-7-4-5-12-15-7/h4-6,8H,3H2,1-2H3,(H3,11,14,17)(H2,12,13,15,16)
InChIKeyFPQGDUNBGUCLLI-UHFFFAOYSA-N
XLogP0.43
TPSA112.90 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 50.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3R)-N-(4-acetamidophenyl)-2-(carbamoylamino)-3-methylpentanamide
CID 2093787
4-[[2-(carbamoylamino)-3-methylpentanoyl]amino]benzamide
CID 24640883
2-(carbamoylamino)-3-methyl-N-(4-propan-2-ylphenyl)pentanamide
CID 42908939
2-(carbamoylamino)-N-[4-(hydroxymethyl)phenyl]-3-methylpentanamide
CID 64792800
2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide
CID 115633314
2-propyl-N-(1H-pyrazol-5-yl)pentanamide
CID 115532341
2-acetamido-N-(1H-pyrazol-5-yl)propanamide
CID 61393558
2-(carbamoylamino)-N-(2-ethylbutyl)-3-methylpentanamide
CID 115613559
2-(carbamoylamino)-N-[(2S)-2-hydroxypropyl]-3-methylpentanamide
CID 83029431
2-(carbamoylamino)-3-methyl-N-(4-phenylphenyl)pentanamide
CID 4785458
(2S,3S)-2-(carbamoylamino)-3-methyl-N-propylpentanamide
CID 95262479
(2S,3R)-2-(carbamoylamino)-3-methyl-N-[(4-methylphenyl)methyl]pentanamide
CID 2671676

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide?
The IUPAC name of 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide (CID 61393913) is 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide.
What is the SMILES notation for 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide?
The canonical SMILES for 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide is CCC(C)C(NC(N)=O)C(=O)Nc1ccn[nH]1.
What is the InChIKey of 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide?
The InChIKey is FPQGDUNBGUCLLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-3-6(2)8(14-10(11)17)9(16)13-7-4-5-12-15-7/h4-6,8H,3H2,1-2H3,(H3,11,14,17)(H2,12,13,15,16).
What are the key properties of 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide?
2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide has a molecular weight of 239.28 g/mol, XLogP of 0.43, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-3-methyl-N-(1H-pyrazol-5-yl)pentanamide is sourced from PubChem (CID 61393913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).