N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine

C15H30N2O — CID 79669822

IUPACN-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCCNC(C1CCCC1)C1CN(CC)CCO1
InChIInChI=1S/C15H30N2O/c1-3-9-16-15(13-7-5-6-8-13)14-12-17(4-2)10-11-18-14/h13-16H,3-12H2,1-2H3
InChIKeyGZKIPXMJOPIHFO-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds6

About N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine

N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine (PubChem CID 79669822) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine
PubChem CID79669822
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCCNC(C1CCCC1)C1CN(CC)CCO1
InChIInChI=1S/C15H30N2O/c1-3-9-16-15(13-7-5-6-8-13)14-12-17(4-2)10-11-18-14/h13-16H,3-12H2,1-2H3
InChIKeyGZKIPXMJOPIHFO-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine?
The IUPAC name of N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine (CID 79669822) is N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine?
The canonical SMILES for N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine is CCCNC(C1CCCC1)C1CN(CC)CCO1.
What is the InChIKey of N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine?
The InChIKey is GZKIPXMJOPIHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-9-16-15(13-7-5-6-8-13)14-12-17(4-2)10-11-18-14/h13-16H,3-12H2,1-2H3.
What are the key properties of N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine?
N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl-(4-ethylmorpholin-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 79669822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).