N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine

C18H28N2 — CID 116517695

IUPACN,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine
SMILESCNC(C1CC1c1ccccc1)C1(N(C)C)CCCC1
InChIInChI=1S/C18H28N2/c1-19-17(18(20(2)3)11-7-8-12-18)16-13-15(16)14-9-5-4-6-10-14/h4-6,9-10,15-17,19H,7-8,11-13H2,1-3H3
InChIKeyWUCCJWNAPGFZMK-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.25
Rot. Bonds5

About N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine

N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine (PubChem CID 116517695) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine
PubChem CID116517695
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC NameN,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine
SMILESCNC(C1CC1c1ccccc1)C1(N(C)C)CCCC1
InChIInChI=1S/C18H28N2/c1-19-17(18(20(2)3)11-7-8-12-18)16-13-15(16)14-9-5-4-6-10-14/h4-6,9-10,15-17,19H,7-8,11-13H2,1-3H3
InChIKeyWUCCJWNAPGFZMK-UHFFFAOYSA-N
XLogP3.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1-methylcyclohexyl)-(2-phenylcyclopropyl)methyl]hydrazine
CID 106831395
1-[amino-(2-phenylcyclopropyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 116517701
1-cyclobutyl-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 116517534
N-methyl-1-(2-phenylcyclopropyl)prop-2-yn-1-amine
CID 104995936
1-[(3,4-dimethylcyclohexyl)-(methylamino)methyl]-N,N-dimethylcycloheptan-1-amine
CID 79064554
N-[(2-methylthiolan-2-yl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 105189092
N,N-dimethyl-1-[1-(methylamino)-2-phenylethyl]cyclopentan-1-amine
CID 79070215
(1-methoxycycloheptyl)-(2-phenylcyclopropyl)methanamine
CID 116769823
(2,2-dimethylcyclohexyl)-(2-phenylcyclopropyl)methanol
CID 107193020
2-cyclopropyl-N-methyl-1-(2-phenylcyclopropyl)ethanamine
CID 116517798
1-[(1R,2S)-2-phenylcyclopropyl]ethanamine
CID 57373127
N-methyl-1-(5-methyloxolan-3-yl)-1-(2-phenylcyclopropyl)methanamine
CID 105052716

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine?
The IUPAC name of N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine (CID 116517695) is N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine is CNC(C1CC1c1ccccc1)C1(N(C)C)CCCC1.
What is the InChIKey of N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine?
The InChIKey is WUCCJWNAPGFZMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-19-17(18(20(2)3)11-7-8-12-18)16-13-15(16)14-9-5-4-6-10-14/h4-6,9-10,15-17,19H,7-8,11-13H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine?
N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine has a molecular weight of 272.44 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[methylamino-(2-phenylcyclopropyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 116517695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).