N-(cyclopentylmethyl)-2-methylpropanamide;ethane

C12H25NO — CID 176960669

IUPACN-(cyclopentylmethyl)-2-methylpropanamide;ethane
SMILESCC.CC(C)C(=O)NCC1CCCC1
InChIInChI=1S/C10H19NO.C2H6/c1-8(2)10(12)11-7-9-5-3-4-6-9;1-2/h8-9H,3-7H2,1-2H3,(H,11,12);1-2H3
InChIKeyMNIIKRVAHJHDRR-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.97
Rot. Bonds3

About N-(cyclopentylmethyl)-2-methylpropanamide;ethane

N-(cyclopentylmethyl)-2-methylpropanamide;ethane (PubChem CID 176960669) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-methylpropanamide;ethane.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-methylpropanamide;ethane
PubChem CID176960669
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-(cyclopentylmethyl)-2-methylpropanamide;ethane
SMILESCC.CC(C)C(=O)NCC1CCCC1
InChIInChI=1S/C10H19NO.C2H6/c1-8(2)10(12)11-7-9-5-3-4-6-9;1-2/h8-9H,3-7H2,1-2H3,(H,11,12);1-2H3
InChIKeyMNIIKRVAHJHDRR-UHFFFAOYSA-N
XLogP2.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(cyclopentylmethyl)-2-methylpropanamide
CID 58333395
2-methyl-N-(thian-4-ylmethyl)propanamide
CID 115625101
2-amino-N-(cyclohexylmethyl)propanamide
CID 43215382
2-amino-N-(cyclooctylmethyl)propanamide;hydrochloride
CID 119299452
2-methyl-N-[(3-oxocyclohexyl)methyl]propanamide
CID 158210571
1-(cyclopentylmethyl)-3-propan-2-ylurea
CID 84521639
N-(cyclobutylmethyl)-2-methyl-3-(methylamino)propanamide
CID 79196076
(2R)-2-amino-N-(cyclobutylmethyl)-3-methylbutanamide
CID 79011849
2-methyl-N-[[3-(trifluoromethyl)cyclohexyl]methyl]propanamide
CID 67953222
propan-2-yl 4-[(2-methylpropanoylamino)methyl]cyclohexane-1-carboxylate
CID 71263253
N-(cyclopropylmethyl)-2-hydroxypropanamide
CID 131088894
2-methyl-N-(oxolan-3-ylmethyl)propanamide
CID 60757135

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-methylpropanamide;ethane?
The IUPAC name of N-(cyclopentylmethyl)-2-methylpropanamide;ethane (CID 176960669) is N-(cyclopentylmethyl)-2-methylpropanamide;ethane.
What is the SMILES notation for N-(cyclopentylmethyl)-2-methylpropanamide;ethane?
The canonical SMILES for N-(cyclopentylmethyl)-2-methylpropanamide;ethane is CC.CC(C)C(=O)NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-2-methylpropanamide;ethane?
The InChIKey is MNIIKRVAHJHDRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.C2H6/c1-8(2)10(12)11-7-9-5-3-4-6-9;1-2/h8-9H,3-7H2,1-2H3,(H,11,12);1-2H3.
What are the key properties of N-(cyclopentylmethyl)-2-methylpropanamide;ethane?
N-(cyclopentylmethyl)-2-methylpropanamide;ethane has a molecular weight of 199.34 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-2-methylpropanamide;ethane is sourced from PubChem (CID 176960669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).