1-amino-N-propan-2-ylcyclopentane-1-carboxamide

C9H18N2O — CID 60866495

IUPAC1-amino-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)C1(N)CCCC1
InChIInChI=1S/C9H18N2O/c1-7(2)11-8(12)9(10)5-3-4-6-9/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyLBWYHGSNIQBKCD-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.78
Rot. Bonds2

About 1-amino-N-propan-2-ylcyclopentane-1-carboxamide

1-amino-N-propan-2-ylcyclopentane-1-carboxamide (PubChem CID 60866495) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-amino-N-propan-2-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-propan-2-ylcyclopentane-1-carboxamide
PubChem CID60866495
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-amino-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)C1(N)CCCC1
InChIInChI=1S/C9H18N2O/c1-7(2)11-8(12)9(10)5-3-4-6-9/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyLBWYHGSNIQBKCD-UHFFFAOYSA-N
XLogP0.78
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-propan-2-ylcyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-propan-2-ylcyclopentane-1-carboxamide (CID 60866495) is 1-amino-N-propan-2-ylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-propan-2-ylcyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-propan-2-ylcyclopentane-1-carboxamide is CC(C)NC(=O)C1(N)CCCC1.
What is the InChIKey of 1-amino-N-propan-2-ylcyclopentane-1-carboxamide?
The InChIKey is LBWYHGSNIQBKCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(2)11-8(12)9(10)5-3-4-6-9/h7H,3-6,10H2,1-2H3,(H,11,12).
What are the key properties of 1-amino-N-propan-2-ylcyclopentane-1-carboxamide?
1-amino-N-propan-2-ylcyclopentane-1-carboxamide has a molecular weight of 170.26 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-propan-2-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 60866495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).