(1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide

C11H17Cl2NO — CID 93233548

IUPAC(1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide
SMILESC[C@]1(C(=O)NCC2CCCC2)CC1(Cl)Cl
InChIInChI=1S/C11H17Cl2NO/c1-10(7-11(10,12)13)9(15)14-6-8-4-2-3-5-8/h8H,2-7H2,1H3,(H,14,15)/t10-/m1/s1
InChIKeyMXMNTVWKFASJCS-SNVBAGLBSA-N
MW250.17 g/mol
LogP2.88
Rot. Bonds3

About (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide

(1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide (PubChem CID 93233548) has the molecular formula C11H17Cl2NO and a molecular weight of 250.17 g/mol. Its IUPAC name is (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name(1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide
PubChem CID93233548
Molecular FormulaC11H17Cl2NO
Molecular Weight250.17 g/mol
Exact Mass249.07
IUPAC Name(1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide
SMILESC[C@]1(C(=O)NCC2CCCC2)CC1(Cl)Cl
InChIInChI=1S/C11H17Cl2NO/c1-10(7-11(10,12)13)9(15)14-6-8-4-2-3-5-8/h8H,2-7H2,1H3,(H,14,15)/t10-/m1/s1
InChIKeyMXMNTVWKFASJCS-SNVBAGLBSA-N
XLogP2.88
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.17
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

(1R)-2,2-dichloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-methylcyclopropane-1-carboxamide
CID 98681847
(2S)-N-(cyclohexylmethyl)-2-methyloxirane-2-carboxamide
CID 166779998
1-amino-N-(cyclopentylmethyl)cyclopropane-1-carboxamide
CID 65463779
(1R)-2,2-dichloro-1-methyl-N-[(2S)-oxan-2-yl]oxycyclopropane-1-carboxamide
CID 94820955
N-(cyclopentylmethyl)-1-(methylaminomethyl)cyclobutane-1-carboxamide
CID 115183725
N-[(4-hydroxycyclohexyl)methyl]-1-methylcyclopentane-1-carboxamide
CID 114146551
1-methyl-N-(piperidin-4-ylmethyl)cyclobutane-1-carboxamide
CID 166176335
N-(cyclohexylmethyl)-3-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119672528
1-methyl-N-(piperidin-4-ylmethyl)cyclopropane-1-carboxamide
CID 130163320
1-(cyclobutylmethyl)-3-(cyclohexylmethyl)urea
CID 155200065
N-(cyclopentylmethyl)-2-methylpropanamide
CID 58333395
(1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 130626986

Frequently Asked Questions

What is the IUPAC name of (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide?
The IUPAC name of (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide (CID 93233548) is (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide.
What is the SMILES notation for (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide?
The canonical SMILES for (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide is C[C@]1(C(=O)NCC2CCCC2)CC1(Cl)Cl.
What is the InChIKey of (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide?
The InChIKey is MXMNTVWKFASJCS-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H17Cl2NO/c1-10(7-11(10,12)13)9(15)14-6-8-4-2-3-5-8/h8H,2-7H2,1H3,(H,14,15)/t10-/m1/s1.
What are the key properties of (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide?
(1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide has a molecular weight of 250.17 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2,2-dichloro-N-(cyclopentylmethyl)-1-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 93233548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).