N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide

C15H26N2O3 — CID 110921981

IUPACN-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide
SMILESO=C(CC1CCCC1)NCCNC(=O)C1(O)CCCC1
InChIInChI=1S/C15H26N2O3/c18-13(11-12-5-1-2-6-12)16-9-10-17-14(19)15(20)7-3-4-8-15/h12,20H,1-11H2,(H,16,18)(H,17,19)
InChIKeyJAUJBDABGDTLFF-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.10
Rot. Bonds6

About N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide

N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide (PubChem CID 110921981) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide
PubChem CID110921981
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC NameN-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide
SMILESO=C(CC1CCCC1)NCCNC(=O)C1(O)CCCC1
InChIInChI=1S/C15H26N2O3/c18-13(11-12-5-1-2-6-12)16-9-10-17-14(19)15(20)7-3-4-8-15/h12,20H,1-11H2,(H,16,18)(H,17,19)
InChIKeyJAUJBDABGDTLFF-UHFFFAOYSA-N
XLogP1.10
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide (CID 110921981) is N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide is O=C(CC1CCCC1)NCCNC(=O)C1(O)CCCC1.
What is the InChIKey of N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide?
The InChIKey is JAUJBDABGDTLFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c18-13(11-12-5-1-2-6-12)16-9-10-17-14(19)15(20)7-3-4-8-15/h12,20H,1-11H2,(H,16,18)(H,17,19).
What are the key properties of N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide?
N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide has a molecular weight of 282.38 g/mol, XLogP of 1.10, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-cyclopentylacetyl)amino]ethyl]-1-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110921981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).