N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine

C15H32N2O — CID 155751003

IUPACN-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine
SMILESCCCCC1C(CN(C)CC(C)C)OCCN1C
InChIInChI=1S/C15H32N2O/c1-6-7-8-14-15(18-10-9-17(14)5)12-16(4)11-13(2)3/h13-15H,6-12H2,1-5H3
InChIKeyKTLZHAATHRHDDU-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.46
Rot. Bonds7

About N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine

N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine (PubChem CID 155751003) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine
PubChem CID155751003
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC NameN-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine
SMILESCCCCC1C(CN(C)CC(C)C)OCCN1C
InChIInChI=1S/C15H32N2O/c1-6-7-8-14-15(18-10-9-17(14)5)12-16(4)11-13(2)3/h13-15H,6-12H2,1-5H3
InChIKeyKTLZHAATHRHDDU-UHFFFAOYSA-N
XLogP2.46
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 3064888
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1-Methyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
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1-Ethyl-2-[(2-methylpropan-2-yl)oxymethyl]piperidine
CID 58365051
(2R,3S,6S)-N,2,6-trimethyl-N-propyloxan-3-amine
CID 60018439
(2R,3S,6S)-N-ethyl-N,2,6-trimethyloxan-3-amine
CID 60018501
2-Pentyl-4-propylmorpholine
CID 67376987
N-methyl-N-(oxan-2-ylmethyl)propan-2-amine
CID 68035447
2-Butyl-4-ethyl-3-propylmorpholine
CID 70861614
3-Butyl-4-tert-butyl-2-methylmorpholine
CID 70861633
2-methoxy-N,N-bis(2-methylpropyl)heptan-3-amine
CID 89657992

Frequently Asked Questions

What is the IUPAC name of N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine?
The IUPAC name of N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine (CID 155751003) is N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine is CCCCC1C(CN(C)CC(C)C)OCCN1C.
What is the InChIKey of N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine?
The InChIKey is KTLZHAATHRHDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-6-7-8-14-15(18-10-9-17(14)5)12-16(4)11-13(2)3/h13-15H,6-12H2,1-5H3.
What are the key properties of N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine?
N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine has a molecular weight of 256.43 g/mol, XLogP of 2.46, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-butyl-4-methylmorpholin-2-yl)methyl]-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 155751003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).