(2R)-2-chloro-N-cyclohexyl-N-methylpropanamide

C10H18ClNO — CID 2432631

IUPAC(2R)-2-chloro-N-cyclohexyl-N-methylpropanamide
SMILESC[C@@H](Cl)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C10H18ClNO/c1-8(11)10(13)12(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3/t8-/m1/s1
InChIKeyVXOMDVJGNBUFAL-MRVPVSSYSA-N
MW203.71 g/mol
LogP2.40
Rot. Bonds2

About (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide

(2R)-2-chloro-N-cyclohexyl-N-methylpropanamide (PubChem CID 2432631) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide.

Molecular Properties

Compound Name(2R)-2-chloro-N-cyclohexyl-N-methylpropanamide
PubChem CID2432631
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name(2R)-2-chloro-N-cyclohexyl-N-methylpropanamide
SMILESC[C@@H](Cl)C(=O)N(C)C1CCCCC1
InChIInChI=1S/C10H18ClNO/c1-8(11)10(13)12(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3/t8-/m1/s1
InChIKeyVXOMDVJGNBUFAL-MRVPVSSYSA-N
XLogP2.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Chloro-N,N-dicyclohexyl-acetamide
CID 222397
2-chloro-N-cyclohexyl-N-methylacetamide
CID 1807193
2-chloro-N-cyclohexylpropanamide
CID 3613317
2-Chloro-1-(2-ethylpiperidin-1-yl)ethan-1-one
CID 4132411
1-(Chloroacetyl)-2-methylpiperidine
CID 107305
2-Chloro-1-(piperidin-1-yl)propan-1-one
CID 3282976
2-Chloro-n,n-dipentylacetamide
CID 222384
2-chloro-N-cyclohexyl-N-ethylpropanamide
CID 4666994
2-Chloro-1-(2,6-dimethylpiperidin-1-yl)ethan-1-one
CID 4463149
2-Chloro-N-cyclohexyl-N-methylpropanamide
CID 5152357
2-chloro-N,N-bis(propan-2-yl)propanamide
CID 13345096
1-(Azepan-1-yl)-2-chloropropan-1-one
CID 14209027

Frequently Asked Questions

What is the IUPAC name of (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide?
The IUPAC name of (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide (CID 2432631) is (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide.
What is the SMILES notation for (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide?
The canonical SMILES for (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide is C[C@@H](Cl)C(=O)N(C)C1CCCCC1.
What is the InChIKey of (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide?
The InChIKey is VXOMDVJGNBUFAL-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-8(11)10(13)12(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3/t8-/m1/s1.
What are the key properties of (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide?
(2R)-2-chloro-N-cyclohexyl-N-methylpropanamide has a molecular weight of 203.71 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-chloro-N-cyclohexyl-N-methylpropanamide is sourced from PubChem (CID 2432631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).