1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine

C14H20ClN — CID 106797878

IUPAC1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine
SMILESCCNC(C)C1(Cc2ccc(Cl)cc2)CC1
InChIInChI=1S/C14H20ClN/c1-3-16-11(2)14(8-9-14)10-12-4-6-13(15)7-5-12/h4-7,11,16H,3,8-10H2,1-2H3
InChIKeyCDZQZAFYDHNILP-UHFFFAOYSA-N
MW237.77 g/mol
LogP3.66
Rot. Bonds5

About 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine

1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine (PubChem CID 106797878) has the molecular formula C14H20ClN and a molecular weight of 237.77 g/mol. Its IUPAC name is 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine.

Molecular Properties

Compound Name1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine
PubChem CID106797878
Molecular FormulaC14H20ClN
Molecular Weight237.77 g/mol
Exact Mass237.13
IUPAC Name1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine
SMILESCCNC(C)C1(Cc2ccc(Cl)cc2)CC1
InChIInChI=1S/C14H20ClN/c1-3-16-11(2)14(8-9-14)10-12-4-6-13(15)7-5-12/h4-7,11,16H,3,8-10H2,1-2H3
InChIKeyCDZQZAFYDHNILP-UHFFFAOYSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-benzylcyclopropyl)-N-ethylethanamine
CID 106797823
N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine
CID 106797794
N-[1-[1-[(4-tert-butylphenyl)methyl]cyclopropyl]ethyl]propan-1-amine
CID 106797931
N-[[1-[(4-chlorophenyl)methyl]cyclobutyl]methyl]-2-methylpropan-1-amine
CID 65196271
1-chloro-4-[(1-methylcyclopropyl)methyl]benzene
CID 134855306
1-[[1-(1-chloroethyl)cyclopropyl]methyl]-4-methylbenzene
CID 106798408
3-[(4-chlorophenyl)methyl]-N-ethyl-4-methylpentan-2-amine
CID 55132814
1-(4-chlorophenyl)-N-ethyl-3-methylpentan-2-amine
CID 61066271
N-[1-[1-[(2-chloro-6-fluorophenyl)methyl]cyclopropyl]ethyl]propan-1-amine
CID 106797913
2-(4-chlorophenyl)-N-ethyl-1-(2,3,4-trifluorophenyl)ethanamine
CID 62964463
1-[1-[(2,4-dichlorophenyl)methyl]cyclopropyl]-N-methylethanamine
CID 106797533
2-(4-chlorophenyl)-1-(3,5-dichlorophenyl)-N-ethylethanamine
CID 63527053

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine?
The IUPAC name of 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine (CID 106797878) is 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine.
What is the SMILES notation for 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine?
The canonical SMILES for 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine is CCNC(C)C1(Cc2ccc(Cl)cc2)CC1.
What is the InChIKey of 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine?
The InChIKey is CDZQZAFYDHNILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN/c1-3-16-11(2)14(8-9-14)10-12-4-6-13(15)7-5-12/h4-7,11,16H,3,8-10H2,1-2H3.
What are the key properties of 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine?
1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine has a molecular weight of 237.77 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(4-chlorophenyl)methyl]cyclopropyl]-N-ethylethanamine is sourced from PubChem (CID 106797878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).