7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine

C13H25N — CID 81422057

IUPAC7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine
SMILESCCCNC1C2CCCC2C1(C)CC
InChIInChI=1S/C13H25N/c1-4-9-14-12-10-7-6-8-11(10)13(12,3)5-2/h10-12,14H,4-9H2,1-3H3
InChIKeyNWVRDYQPCYGCQU-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.20
Rot. Bonds4

About 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine

7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine (PubChem CID 81422057) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine.

Molecular Properties

Compound Name7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine
PubChem CID81422057
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine
SMILESCCCNC1C2CCCC2C1(C)CC
InChIInChI=1S/C13H25N/c1-4-9-14-12-10-7-6-8-11(10)13(12,3)5-2/h10-12,14H,4-9H2,1-3H3
InChIKeyNWVRDYQPCYGCQU-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7,7-dimethyl-N-propylbicyclo[3.2.0]heptan-6-amine
CID 81422181
14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine
CID 81422701
7,7-dimethyl-N-propyl-2-oxabicyclo[3.2.0]heptan-6-amine
CID 54594844
N-ethyl-9,9-dimethylbicyclo[5.2.0]nonan-8-amine
CID 81422931
5-cyclobutyloxy-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79856523
(1S,6R)-8,8-dimethyl-N-(2-methylsulfinylethyl)bicyclo[4.2.0]octan-7-amine
CID 103816158
N-propylspiro[2-oxabicyclo[3.2.0]heptane-7,1'-cyclobutane]-6-amine
CID 115776639
10,10-diethyl-N-methylbicyclo[6.2.0]decan-9-amine
CID 81421950
3-cyclopentyloxy-2-ethyl-2-methyl-N-propylcyclobutan-1-amine
CID 66356756
1-ethyl-6-methoxy-1-methyl-N-propyl-2a,3,4,8b-tetrahydro-2H-cyclobuta[a]naphthalen-2-amine
CID 81422543
(1R,2S,6R,7S,8R)-N-propyltricyclo[5.2.1.02,6]decan-8-amine
CID 124708771
3,3-dimethyl-N-propylbicyclo[2.2.1]heptan-2-amine;hydrochloride
CID 138397483

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine?
The IUPAC name of 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine (CID 81422057) is 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine.
What is the SMILES notation for 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine?
The canonical SMILES for 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine is CCCNC1C2CCCC2C1(C)CC.
What is the InChIKey of 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine?
The InChIKey is NWVRDYQPCYGCQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-4-9-14-12-10-7-6-8-11(10)13(12,3)5-2/h10-12,14H,4-9H2,1-3H3.
What are the key properties of 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine?
7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine has a molecular weight of 195.35 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-7-methyl-N-propylbicyclo[3.2.0]heptan-6-amine is sourced from PubChem (CID 81422057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).