1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide

C14H27NO2 — CID 97016024

IUPAC1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide
SMILESCC(C)COC[C@H](C)NC(=O)C1(C)CCCC1
InChIInChI=1S/C14H27NO2/c1-11(2)9-17-10-12(3)15-13(16)14(4)7-5-6-8-14/h11-12H,5-10H2,1-4H3,(H,15,16)/t12-/m0/s1
InChIKeyULQBNBLVAZBVJR-LBPRGKRZSA-N
MW241.37 g/mol
LogP2.74
Rot. Bonds6

About 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide

1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide (PubChem CID 97016024) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide
PubChem CID97016024
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide
SMILESCC(C)COC[C@H](C)NC(=O)C1(C)CCCC1
InChIInChI=1S/C14H27NO2/c1-11(2)9-17-10-12(3)15-13(16)14(4)7-5-6-8-14/h11-12H,5-10H2,1-4H3,(H,15,16)/t12-/m0/s1
InChIKeyULQBNBLVAZBVJR-LBPRGKRZSA-N
XLogP2.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide?
The IUPAC name of 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide (CID 97016024) is 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide is CC(C)COC[C@H](C)NC(=O)C1(C)CCCC1.
What is the InChIKey of 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide?
The InChIKey is ULQBNBLVAZBVJR-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H27NO2/c1-11(2)9-17-10-12(3)15-13(16)14(4)7-5-6-8-14/h11-12H,5-10H2,1-4H3,(H,15,16)/t12-/m0/s1.
What are the key properties of 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide?
1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide has a molecular weight of 241.37 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 97016024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).