N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide

C9H18N2O — CID 131085914

IUPACN-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide
SMILESCC(=O)N[C@@H]1CC[C@@H](N(C)C)C1
InChIInChI=1S/C9H18N2O/c1-7(12)10-8-4-5-9(6-8)11(2)3/h8-9H,4-6H2,1-3H3,(H,10,12)/t8-,9-/m1/s1
InChIKeyIRKYCGHPYPFGRL-RKDXNWHRSA-N
MW170.26 g/mol
LogP0.61
Rot. Bonds2

About N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide

N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide (PubChem CID 131085914) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide.

Molecular Properties

Compound NameN-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide
PubChem CID131085914
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide
SMILESCC(=O)N[C@@H]1CC[C@@H](N(C)C)C1
InChIInChI=1S/C9H18N2O/c1-7(12)10-8-4-5-9(6-8)11(2)3/h8-9H,4-6H2,1-3H3,(H,10,12)/t8-,9-/m1/s1
InChIKeyIRKYCGHPYPFGRL-RKDXNWHRSA-N
XLogP0.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide?
The IUPAC name of N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide (CID 131085914) is N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide.
What is the SMILES notation for N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide?
The canonical SMILES for N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide is CC(=O)N[C@@H]1CC[C@@H](N(C)C)C1.
What is the InChIKey of N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide?
The InChIKey is IRKYCGHPYPFGRL-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(12)10-8-4-5-9(6-8)11(2)3/h8-9H,4-6H2,1-3H3,(H,10,12)/t8-,9-/m1/s1.
What are the key properties of N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide?
N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide has a molecular weight of 170.26 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,3R)-3-(dimethylamino)cyclopentyl]acetamide is sourced from PubChem (CID 131085914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).