N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide

C14H18ClNO2 — CID 110428070

IUPACN-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)C(C)C1CC1
InChIInChI=1S/C14H18ClNO2/c1-8-6-12(13(18-3)7-11(8)15)16-14(17)9(2)10-4-5-10/h6-7,9-10H,4-5H2,1-3H3,(H,16,17)
InChIKeyNPRQSFFDFXPCQT-UHFFFAOYSA-N
MW267.76 g/mol
LogP3.64
Rot. Bonds4

About N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide

N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide (PubChem CID 110428070) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide.

Molecular Properties

Compound NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide
PubChem CID110428070
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)C(C)C1CC1
InChIInChI=1S/C14H18ClNO2/c1-8-6-12(13(18-3)7-11(8)15)16-14(17)9(2)10-4-5-10/h6-7,9-10H,4-5H2,1-3H3,(H,16,17)
InChIKeyNPRQSFFDFXPCQT-UHFFFAOYSA-N
XLogP3.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide
CID 41192472
2-bromo-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide
CID 107902832
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(4-chloro-2-methoxy-5-methylphenyl)oxamide
CID 108532266
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(4-methoxypiperidin-1-yl)propanamide
CID 17397855
(2R)-2-amino-N-(4-chloro-2-methoxy-5-methylphenyl)-3,3-dimethylbutanamide
CID 103928289
2-chloro-N-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]propanamide
CID 43328804
4-chloro-N-(1-cyclopropylethyl)-2-methoxy-5-methylaniline
CID 43191804
N-(4-chloro-2-methoxy-5-methylphenyl)-3-methylbutanamide
CID 9397630
5-amino-N-(4-chloro-2-methoxy-5-methylphenyl)-2-methylpentanamide
CID 104683435
3-(2-cyclopropylpropanoylamino)-4-methoxybenzenesulfonyl chloride
CID 83153776
(2S)-N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 1300506
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(4-methylphenyl)sulfanylpropanamide
CID 23914557

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide?
The IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide (CID 110428070) is N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide.
What is the SMILES notation for N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide?
The canonical SMILES for N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide is COc1cc(Cl)c(C)cc1NC(=O)C(C)C1CC1.
What is the InChIKey of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide?
The InChIKey is NPRQSFFDFXPCQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c1-8-6-12(13(18-3)7-11(8)15)16-14(17)9(2)10-4-5-10/h6-7,9-10H,4-5H2,1-3H3,(H,16,17).
What are the key properties of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide?
N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide has a molecular weight of 267.76 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide is sourced from PubChem (CID 110428070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).