N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide

C14H19ClN2O — CID 119799433

IUPACN-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NC1(c2cccc(Cl)c2)CC1
InChIInChI=1S/C14H19ClN2O/c1-10(9-16-2)13(18)17-14(6-7-14)11-4-3-5-12(15)8-11/h3-5,8,10,16H,6-7,9H2,1-2H3,(H,17,18)
InChIKeyUUVGNZSZXHOGAP-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.30
Rot. Bonds5

About N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide

N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide (PubChem CID 119799433) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide
PubChem CID119799433
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC NameN-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NC1(c2cccc(Cl)c2)CC1
InChIInChI=1S/C14H19ClN2O/c1-10(9-16-2)13(18)17-14(6-7-14)11-4-3-5-12(15)8-11/h3-5,8,10,16H,6-7,9H2,1-2H3,(H,17,18)
InChIKeyUUVGNZSZXHOGAP-UHFFFAOYSA-N
XLogP2.30
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[1-(3-chlorophenyl)cyclopropyl]-2-methylbutanamide;hydrochloride
CID 120501433
1-[1-(3-chlorophenyl)cyclopropyl]-3-(2-hydroxypropyl)urea
CID 110490727
2-methyl-3-(methylamino)-N-(1-phenylcyclobutyl)propanamide;hydrochloride
CID 119697180
2-methyl-3-(methylamino)-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]propanamide;hydrochloride
CID 119806417
[1-(3-chlorophenyl)cyclopropyl]carbamic acid
CID 122529573
1-[1-(3-chlorophenyl)cyclopropyl]-3-ethylurea
CID 110490719
N-[1-(3-chlorophenyl)cyclopentyl]acetamide
CID 110441196
N-[1-(3-chlorophenyl)cyclopropyl]-4-methylbenzamide
CID 110440424
N-[1-(4-fluorophenyl)cyclopentyl]-2-methyl-3-(methylamino)propanamide
CID 119752714
2,5-dichloro-N-[1-(3-chlorophenyl)cyclopropyl]benzamide
CID 110440796
N-[2-(3-chlorophenyl)ethyl]-2-methyl-3-(methylamino)propanamide
CID 79202005
2-amino-N-[1-(3-chlorophenyl)cyclopentyl]acetamide
CID 110459406

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide (CID 119799433) is N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide is CNCC(C)C(=O)NC1(c2cccc(Cl)c2)CC1.
What is the InChIKey of N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide?
The InChIKey is UUVGNZSZXHOGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-10(9-16-2)13(18)17-14(6-7-14)11-4-3-5-12(15)8-11/h3-5,8,10,16H,6-7,9H2,1-2H3,(H,17,18).
What are the key properties of N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide?
N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide has a molecular weight of 266.77 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)cyclopropyl]-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 119799433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).