N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine

C16H30N2O — CID 120914381

IUPACN-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine
SMILESC1CCC(CNC2CCCC2C2COCCN2)CC1
InChIInChI=1S/C16H30N2O/c1-2-5-13(6-3-1)11-18-15-8-4-7-14(15)16-12-19-10-9-17-16/h13-18H,1-12H2
InChIKeyBKWWGTLIJHZSTQ-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.31
Rot. Bonds4

About N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine

N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine (PubChem CID 120914381) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine
PubChem CID120914381
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine
SMILESC1CCC(CNC2CCCC2C2COCCN2)CC1
InChIInChI=1S/C16H30N2O/c1-2-5-13(6-3-1)11-18-15-8-4-7-14(15)16-12-19-10-9-17-16/h13-18H,1-12H2
InChIKeyBKWWGTLIJHZSTQ-UHFFFAOYSA-N
XLogP2.31
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine?
The IUPAC name of N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine (CID 120914381) is N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine.
What is the SMILES notation for N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine?
The canonical SMILES for N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine is C1CCC(CNC2CCCC2C2COCCN2)CC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine?
The InChIKey is BKWWGTLIJHZSTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-5-13(6-3-1)11-18-15-8-4-7-14(15)16-12-19-10-9-17-16/h13-18H,1-12H2.
What are the key properties of N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine?
N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine has a molecular weight of 266.43 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine is sourced from PubChem (CID 120914381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).