cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide

C14H25NO — CID 124840040

IUPACcis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide
SMILESCCC[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1C[C@H]1C
InChIInChI=1S/C14H25NO/c1-3-6-11-7-4-5-8-13(11)15-14(16)12-9-10(12)2/h10-13H,3-9H2,1-2H3,(H,15,16)/t10-,11-,12+,13+/m1/s1
InChIKeyCWOSJUCRWHGUBC-NDBYEHHHSA-N
MW223.36 g/mol
LogP3.12
Rot. Bonds4

About cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide

cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide (PubChem CID 124840040) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide
PubChem CID124840040
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Namecis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide
SMILESCCC[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1C[C@H]1C
InChIInChI=1S/C14H25NO/c1-3-6-11-7-4-5-8-13(11)15-14(16)12-9-10(12)2/h10-13H,3-9H2,1-2H3,(H,15,16)/t10-,11-,12+,13+/m1/s1
InChIKeyCWOSJUCRWHGUBC-NDBYEHHHSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(chloromethyl)cyclopentyl]-2-methylcyclopropane-1-carboxamide
CID 106366126
2-[(2-propylcyclopropyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 114110539
2-methyl-N-(2-methylcyclohexyl)cyclopropane-1-carboxamide
CID 4084655
2-methyl-N-[(1R,2S)-2-propylcyclohexyl]propanamide
CID 95568853
2-amino-N-(2-propylcyclopropyl)cycloheptane-1-carboxamide
CID 113267243
2-amino-N-(2-ethylcyclohexyl)-5-methylcyclohexane-1-carboxamide
CID 65454165
2-[(2-propylcyclopropyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 106704168
1-methoxy-3-[(1S,2R)-2-propylcyclohexyl]urea
CID 97027382
(2R)-2-ethoxy-N-[(1R,2R)-2-propylcyclohexyl]propanamide
CID 97027372
(2S)-2-ethoxy-N-[(1S,2R)-2-propylcyclohexyl]propanamide
CID 124743400
2-[[2-(hydroxymethyl)cyclopentyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 106359251
trans-(1R,2S)-2-(aminomethyl)-N-(2-methylcyclopropyl)cyclopentane-1-carboxamide
CID 130760150

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide?
The IUPAC name of cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide (CID 124840040) is cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide.
What is the SMILES notation for cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide?
The canonical SMILES for cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide is CCC[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1C[C@H]1C.
What is the InChIKey of cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide?
The InChIKey is CWOSJUCRWHGUBC-NDBYEHHHSA-N. The full InChI is InChI=1S/C14H25NO/c1-3-6-11-7-4-5-8-13(11)15-14(16)12-9-10(12)2/h10-13H,3-9H2,1-2H3,(H,15,16)/t10-,11-,12+,13+/m1/s1.
What are the key properties of cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide?
cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide has a molecular weight of 223.36 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-propylcyclohexyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 124840040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).