4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine

C16H36N2O — CID 142615810

IUPAC4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine
SMILESCC(C)CCCN1CCOCC1.CC(C)CN(C)C
InChIInChI=1S/C10H21NO.C6H15N/c1-10(2)4-3-5-11-6-8-12-9-7-11;1-6(2)5-7(3)4/h10H,3-9H2,1-2H3;6H,5H2,1-4H3
InChIKeyATQOLBIGVMNEHI-UHFFFAOYSA-N
MW272.48 g/mol
LogP2.96
Rot. Bonds6

About 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine

4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine (PubChem CID 142615810) has the molecular formula C16H36N2O and a molecular weight of 272.48 g/mol. Its IUPAC name is 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine.

Molecular Properties

Compound Name4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine
PubChem CID142615810
Molecular FormulaC16H36N2O
Molecular Weight272.48 g/mol
Exact Mass272.28
IUPAC Name4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine
SMILESCC(C)CCCN1CCOCC1.CC(C)CN(C)C
InChIInChI=1S/C10H21NO.C6H15N/c1-10(2)4-3-5-11-6-8-12-9-7-11;1-6(2)5-7(3)4/h10H,3-9H2,1-2H3;6H,5H2,1-4H3
InChIKeyATQOLBIGVMNEHI-UHFFFAOYSA-N
XLogP2.96
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.48
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethylpropan-1-amine;4-(4-methylpentyl)morpholine
CID 176932414
formic acid;4-(4-methylpentyl)morpholine
CID 172564161
4-methyl-N-(2-morpholin-4-ylethyl)pentan-1-amine
CID 61044634
1-(4-methylpentyl)-4-(2-methylpropyl)piperazine
CID 21131473
4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]morpholine
CID 91228276
4-(2-chloroethyl)morpholine;3-chloro-N,N,2-trimethylpropan-1-amine
CID 22403187
4-(4-methylnonyl)morpholine
CID 170444016
N-methyl-1-(4-methylpentyl)-N-(2-methylpropyl)piperidin-4-amine
CID 138728385
(3S)-3-methyl-6-morpholin-4-ylhexan-1-ol
CID 174809295
1,1,1-trifluoro-N-methyl-5-morpholin-4-ylpentan-2-amine
CID 82534956
2-methyl-5-morpholin-4-ylpentanoic acid
CID 20751269
N,N-diethyl-3-methyl-6-morpholin-4-ylhexan-1-amine
CID 142218113

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine?
The IUPAC name of 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine (CID 142615810) is 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine.
What is the SMILES notation for 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine?
The canonical SMILES for 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine is CC(C)CCCN1CCOCC1.CC(C)CN(C)C.
What is the InChIKey of 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine?
The InChIKey is ATQOLBIGVMNEHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.C6H15N/c1-10(2)4-3-5-11-6-8-12-9-7-11;1-6(2)5-7(3)4/h10H,3-9H2,1-2H3;6H,5H2,1-4H3.
What are the key properties of 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine?
4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine has a molecular weight of 272.48 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine is sourced from PubChem (CID 142615810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).