1-(4-methylpentanoylamino)cyclopentane-1-carboxamide

C12H22N2O2 — CID 70921490

IUPAC1-(4-methylpentanoylamino)cyclopentane-1-carboxamide
SMILESCC(C)CCC(=O)NC1(C(N)=O)CCCC1
InChIInChI=1S/C12H22N2O2/c1-9(2)5-6-10(15)14-12(11(13)16)7-3-4-8-12/h9H,3-8H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyQUERYHOGOGDTJN-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.34
Rot. Bonds5

About 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide

1-(4-methylpentanoylamino)cyclopentane-1-carboxamide (PubChem CID 70921490) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-methylpentanoylamino)cyclopentane-1-carboxamide
PubChem CID70921490
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name1-(4-methylpentanoylamino)cyclopentane-1-carboxamide
SMILESCC(C)CCC(=O)NC1(C(N)=O)CCCC1
InChIInChI=1S/C12H22N2O2/c1-9(2)5-6-10(15)14-12(11(13)16)7-3-4-8-12/h9H,3-8H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyQUERYHOGOGDTJN-UHFFFAOYSA-N
XLogP1.34
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide?
The IUPAC name of 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide (CID 70921490) is 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide is CC(C)CCC(=O)NC1(C(N)=O)CCCC1.
What is the InChIKey of 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide?
The InChIKey is QUERYHOGOGDTJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-9(2)5-6-10(15)14-12(11(13)16)7-3-4-8-12/h9H,3-8H2,1-2H3,(H2,13,16)(H,14,15).
What are the key properties of 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide?
1-(4-methylpentanoylamino)cyclopentane-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpentanoylamino)cyclopentane-1-carboxamide is sourced from PubChem (CID 70921490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).