14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine

C19H37N — CID 81422701

IUPAC14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine
SMILESCCCNC1C2CCCCCCCCCCC2C1(C)C
InChIInChI=1S/C19H37N/c1-4-15-20-18-16-13-11-9-7-5-6-8-10-12-14-17(16)19(18,2)3/h16-18,20H,4-15H2,1-3H3
InChIKeyYRSGKZTZTILHKE-UHFFFAOYSA-N
MW279.51 g/mol
LogP5.54
Rot. Bonds3

About 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine

14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine (PubChem CID 81422701) has the molecular formula C19H37N and a molecular weight of 279.51 g/mol. Its IUPAC name is 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine.

Molecular Properties

Compound Name14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine
PubChem CID81422701
Molecular FormulaC19H37N
Molecular Weight279.51 g/mol
Exact Mass279.29
IUPAC Name14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine
SMILESCCCNC1C2CCCCCCCCCCC2C1(C)C
InChIInChI=1S/C19H37N/c1-4-15-20-18-16-13-11-9-7-5-6-8-10-12-14-17(16)19(18,2)3/h16-18,20H,4-15H2,1-3H3
InChIKeyYRSGKZTZTILHKE-UHFFFAOYSA-N
XLogP5.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.51
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine?
The IUPAC name of 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine (CID 81422701) is 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine.
What is the SMILES notation for 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine?
The canonical SMILES for 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine is CCCNC1C2CCCCCCCCCCC2C1(C)C.
What is the InChIKey of 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine?
The InChIKey is YRSGKZTZTILHKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37N/c1-4-15-20-18-16-13-11-9-7-5-6-8-10-12-14-17(16)19(18,2)3/h16-18,20H,4-15H2,1-3H3.
What are the key properties of 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine?
14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine has a molecular weight of 279.51 g/mol, XLogP of 5.54, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 14,14-dimethyl-N-propylbicyclo[10.2.0]tetradecan-13-amine is sourced from PubChem (CID 81422701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).