1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine

C16H32N2 — CID 79069853

IUPAC1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine
SMILESCCCNC(CC1CCC1)C1(N(C)C)CCCC1
InChIInChI=1S/C16H32N2/c1-4-12-17-15(13-14-8-7-9-14)16(18(2)3)10-5-6-11-16/h14-15,17H,4-13H2,1-3H3
InChIKeyBZWRISISZBNVDQ-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds7

About 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine

1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine (PubChem CID 79069853) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine
PubChem CID79069853
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine
SMILESCCCNC(CC1CCC1)C1(N(C)C)CCCC1
InChIInChI=1S/C16H32N2/c1-4-12-17-15(13-14-8-7-9-14)16(18(2)3)10-5-6-11-16/h14-15,17H,4-13H2,1-3H3
InChIKeyBZWRISISZBNVDQ-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-1-[1-(propylamino)but-3-enyl]cyclopentan-1-amine
CID 79070855
N,N-dimethyl-1-[3-methyl-1-(propylamino)butyl]cyclopentan-1-amine
CID 79069925
1-(2-cyclohexyl-1-hydrazinylethyl)-N,N-dimethylcycloheptan-1-amine
CID 105243794
1-[(3-ethylcyclohexyl)-(propylamino)methyl]-N,N-dimethylcyclopentan-1-amine
CID 79058669
N,N-dimethyl-1-[3-methyl-1-(propylamino)butyl]cycloheptan-1-amine
CID 79081393
N,N-dimethyl-1-[2-propan-2-yloxy-1-(propylamino)ethyl]cycloheptan-1-amine
CID 79570086
1-[2-cyclobutyl-1-(ethylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79074775
1-[2-cyclopropyl-1-(ethylamino)ethyl]-N,N,4-trimethylcyclohexan-1-amine
CID 79074963
1-[2-ethoxy-1-(propylamino)ethyl]-N,N-dimethylcycloheptan-1-amine
CID 79570214
N,N-dimethyl-1-[(4-methylcyclohexyl)-(propylamino)methyl]cyclopentan-1-amine
CID 79070623
N-[2-cyclobutyl-1-(1-morpholin-4-ylcyclopentyl)ethyl]propan-1-amine
CID 79062246
1-[4,4-dimethyl-1-(propylamino)pentyl]-N,N-dimethylcyclohexan-1-amine
CID 79067056

Frequently Asked Questions

What is the IUPAC name of 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine?
The IUPAC name of 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine (CID 79069853) is 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine is CCCNC(CC1CCC1)C1(N(C)C)CCCC1.
What is the InChIKey of 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine?
The InChIKey is BZWRISISZBNVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-12-17-15(13-14-8-7-9-14)16(18(2)3)10-5-6-11-16/h14-15,17H,4-13H2,1-3H3.
What are the key properties of 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine?
1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyclobutyl-1-(propylamino)ethyl]-N,N-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79069853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).