N-(3-morpholin-4-ylpropyl)undecan-6-amine

C18H38N2O — CID 43769511

IUPACN-(3-morpholin-4-ylpropyl)undecan-6-amine
SMILESCCCCCC(CCCCC)NCCCN1CCOCC1
InChIInChI=1S/C18H38N2O/c1-3-5-7-10-18(11-8-6-4-2)19-12-9-13-20-14-16-21-17-15-20/h18-19H,3-17H2,1-2H3
InChIKeyLTJHAFHHRCKILL-UHFFFAOYSA-N
MW298.51 g/mol
LogP3.83
Rot. Bonds13

About N-(3-morpholin-4-ylpropyl)undecan-6-amine

N-(3-morpholin-4-ylpropyl)undecan-6-amine (PubChem CID 43769511) has the molecular formula C18H38N2O and a molecular weight of 298.51 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)undecan-6-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)undecan-6-amine
PubChem CID43769511
Molecular FormulaC18H38N2O
Molecular Weight298.51 g/mol
Exact Mass298.30
IUPAC NameN-(3-morpholin-4-ylpropyl)undecan-6-amine
SMILESCCCCCC(CCCCC)NCCCN1CCOCC1
InChIInChI=1S/C18H38N2O/c1-3-5-7-10-18(11-8-6-4-2)19-12-9-13-20-14-16-21-17-15-20/h18-19H,3-17H2,1-2H3
InChIKeyLTJHAFHHRCKILL-UHFFFAOYSA-N
XLogP3.83
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.51
LogP ≤ 53.83
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

4-(Morpholin-4-yl)azepane
CID 56924585
N,N-bis(2-methoxyethyl)piperidin-4-amine
CID 61418821
N-(2-Methoxyethyl)-1-methylpiperidin-4-amine
CID 2761027
1-(2-Methoxyethyl)piperidin-4-amine
CID 20119121
N-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]piperidin-4-amine
CID 44592858
1-ethyl-N-(2-methoxyethyl)piperidin-4-amine
CID 2247136
N-(3-Morpholinopropyl)cycloheptanamine
CID 5143403
1-methyl-N-[3-(morpholin-4-yl)propyl]piperidin-4-amine
CID 4712096
2,6-Dimethyl-4-tridecylmorpholin-4-ium
CID 25201990
N-[2-(4-morpholinyl)ethyl]cyclooctanamine
CID 783927
1-ethyl-N-(1-methoxypropan-2-yl)piperidin-4-amine
CID 2846291
N-(1-methoxypropan-2-yl)-1-methylpiperidin-4-amine
CID 2849472

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)undecan-6-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)undecan-6-amine (CID 43769511) is N-(3-morpholin-4-ylpropyl)undecan-6-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)undecan-6-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)undecan-6-amine is CCCCCC(CCCCC)NCCCN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)undecan-6-amine?
The InChIKey is LTJHAFHHRCKILL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2O/c1-3-5-7-10-18(11-8-6-4-2)19-12-9-13-20-14-16-21-17-15-20/h18-19H,3-17H2,1-2H3.
What are the key properties of N-(3-morpholin-4-ylpropyl)undecan-6-amine?
N-(3-morpholin-4-ylpropyl)undecan-6-amine has a molecular weight of 298.51 g/mol, XLogP of 3.83, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)undecan-6-amine is sourced from PubChem (CID 43769511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).