N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine

C17H36N2O — CID 83100021

IUPACN-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine
SMILESCCCCCCCCCN1CCOCC1CNC(C)C
InChIInChI=1S/C17H36N2O/c1-4-5-6-7-8-9-10-11-19-12-13-20-15-17(19)14-18-16(2)3/h16-18H,4-15H2,1-3H3
InChIKeyXCQMGWGBUBKEQO-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.44
Rot. Bonds11

About N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine

N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine (PubChem CID 83100021) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine
PubChem CID83100021
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC NameN-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine
SMILESCCCCCCCCCN1CCOCC1CNC(C)C
InChIInChI=1S/C17H36N2O/c1-4-5-6-7-8-9-10-11-19-12-13-20-15-17(19)14-18-16(2)3/h16-18H,4-15H2,1-3H3
InChIKeyXCQMGWGBUBKEQO-UHFFFAOYSA-N
XLogP3.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-methyl-1-(4-octylmorpholin-3-yl)methanamine
CID 83099737
3,4-di(tridecyl)morpholine
CID 172742724
N-[[4-(2-methylsulfonylethyl)morpholin-3-yl]methyl]propan-2-amine
CID 83100521
N-[(4-butylmorpholin-3-yl)methyl]ethanamine
CID 83100321
N-[[4-(cyclohexylmethyl)morpholin-3-yl]methyl]propan-2-amine
CID 83100271
5-(3-methylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
CID 62421023
N-[[4-(oxolan-2-ylmethyl)morpholin-3-yl]methyl]propan-2-amine
CID 83099933
1-[(3R)-3-[(propan-2-ylamino)methyl]morpholin-4-yl]ethanone
CID 139553526
4-(9-bromononyl)-3-ethylmorpholine
CID 105343626
N-[[4-[(4-chloro-3-ethyl-1-methylpyrazol-5-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83101344
N-[[4-[(2,5-dimethylpyrazol-3-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100020
N-[(4-cyclopentylmorpholin-3-yl)methyl]propan-2-amine
CID 83100519

Frequently Asked Questions

What is the IUPAC name of N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine?
The IUPAC name of N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine (CID 83100021) is N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine is CCCCCCCCCN1CCOCC1CNC(C)C.
What is the InChIKey of N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine?
The InChIKey is XCQMGWGBUBKEQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-4-5-6-7-8-9-10-11-19-12-13-20-15-17(19)14-18-16(2)3/h16-18H,4-15H2,1-3H3.
What are the key properties of N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine?
N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine has a molecular weight of 284.49 g/mol, XLogP of 3.44, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-nonylmorpholin-3-yl)methyl]propan-2-amine is sourced from PubChem (CID 83100021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).