2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide

C10H18N2O3 — CID 141033463

IUPAC2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide
SMILESNC(=O)C(CC1CCCC1)CN(O)C=O
InChIInChI=1S/C10H18N2O3/c11-10(14)9(6-12(15)7-13)5-8-3-1-2-4-8/h7-9,15H,1-6H2,(H2,11,14)
InChIKeyPBMBHXRBICAVGU-UHFFFAOYSA-N
MW214.26 g/mol
LogP0.52
Rot. Bonds6

About 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide

2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide (PubChem CID 141033463) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide
PubChem CID141033463
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide
SMILESNC(=O)C(CC1CCCC1)CN(O)C=O
InChIInChI=1S/C10H18N2O3/c11-10(14)9(6-12(15)7-13)5-8-3-1-2-4-8/h7-9,15H,1-6H2,(H2,11,14)
InChIKeyPBMBHXRBICAVGU-UHFFFAOYSA-N
XLogP0.52
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-1-[(2S)-2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanoyl]-1-(3-methylbutanoyl)pyrrolidin-1-ium-2-carboxamide
CID 87704793
N-[(2R)-2-(cyclopentylmethyl)-3-[2-(2-methoxyacetyl)diazinan-1-yl]-3-oxopropyl]-N-hydroxyformamide
CID 56680553
2-[2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanoyl]-3,4-dihydropyridazine-1-carboxylic acid
CID 18442603
(2S)-1-[(2R)-2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanoyl]-N-[(cyclopropanecarbonylamino)methyl]pyrrolidine-2-carboxamide
CID 16755320
N-[(2R)-2-(cyclopentylmethyl)-3-oxo-3-[2-(2-phenylacetyl)pyrazolidin-1-yl]propyl]-N-hydroxyformamide
CID 56683894
(2R)-1-[(2S)-2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanoyl]-2-methyl-N-(3-methylbutanoyl)pyrrolidin-1-ium-1-carboxamide
CID 90717324
N-[(2R)-2-(cyclopentylmethyl)-3-[2-(furan-3-carbonyl)diazinan-1-yl]-3-oxopropyl]-N-hydroxyformamide
CID 56663530
N-[(2R)-3-[amino-[4-(cyclopropylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-2-(cyclopentylmethyl)-3-oxopropyl]-N-hydroxyformamide
CID 87695036
[(2S)-1-methoxypropan-2-yl] (2S)-2-carbamoyl-1-[(2R)-2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanoyl]-3,3-dimethylpyrrolidin-1-ium-1-carboxylate
CID 87353987
(2S)-2-(cyclopropylmethyl)butanediamide
CID 70062337
2-(cyclopropylmethyl)butanediamide
CID 21468650
N-[(2R)-3-[2-(6-chloro-1,2,4-benzotriazin-3-yl)hydrazinyl]-2-(cyclopentylmethyl)-3-oxopropyl]-N-hydroxyformamide
CID 87264399

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide?
The IUPAC name of 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide (CID 141033463) is 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide.
What is the SMILES notation for 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide?
The canonical SMILES for 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide is NC(=O)C(CC1CCCC1)CN(O)C=O.
What is the InChIKey of 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide?
The InChIKey is PBMBHXRBICAVGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c11-10(14)9(6-12(15)7-13)5-8-3-1-2-4-8/h7-9,15H,1-6H2,(H2,11,14).
What are the key properties of 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide?
2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide has a molecular weight of 214.26 g/mol, XLogP of 0.52, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethyl)-3-[formyl(hydroxy)amino]propanamide is sourced from PubChem (CID 141033463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).