N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine

C8H18N2O — CID 171530788

IUPACN,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine
SMILESCC1COC[C@H](CN(C)C)N1
InChIInChI=1S/C8H18N2O/c1-7-5-11-6-8(9-7)4-10(2)3/h7-9H,4-6H2,1-3H3/t7?,8-/m0/s1
InChIKeyDWAPDKZZDFUKAT-MQWKRIRWSA-N
MW158.24 g/mol
LogP-0.08
Rot. Bonds2

About N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine

N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine (PubChem CID 171530788) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine
PubChem CID171530788
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC NameN,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine
SMILESCC1COC[C@H](CN(C)C)N1
InChIInChI=1S/C8H18N2O/c1-7-5-11-6-8(9-7)4-10(2)3/h7-9H,4-6H2,1-3H3/t7?,8-/m0/s1
InChIKeyDWAPDKZZDFUKAT-MQWKRIRWSA-N
XLogP-0.08
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethylmorpholine
CID 8862
(3S,5R)-3,5-dimethylmorpholine;hydrochloride
CID 20818712
3-methyl-1-(5-methylmorpholin-3-yl)pentan-2-one
CID 165485552
3-methoxy-3-methyl-1-(5-methylmorpholin-3-yl)butan-2-one
CID 165475193
3-methyl-5-[2-(4-methylphenyl)ethyl]morpholine
CID 82285891
3-[2-(4-ethylphenyl)ethyl]-5-methylmorpholine
CID 116685903
1-(aziridin-2-yl)-N,N-dimethylmethanamine
CID 54502555
1-(3,5-difluorophenyl)-2-(5-methylmorpholin-3-yl)ethanone
CID 116685377
3-[(3,5-dimethylphenoxy)methyl]-5-methylmorpholine
CID 82291344
1-(3-fluorophenyl)-2-(5-methylmorpholin-3-yl)ethanone
CID 116685057
1-(2,5-difluoro-4-methylphenyl)-2-(5-methylmorpholin-3-yl)ethanone
CID 116685375
4-[(dimethylamino)methyl]oxolan-3-amine
CID 66237318

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine (CID 171530788) is N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine is CC1COC[C@H](CN(C)C)N1.
What is the InChIKey of N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine?
The InChIKey is DWAPDKZZDFUKAT-MQWKRIRWSA-N. The full InChI is InChI=1S/C8H18N2O/c1-7-5-11-6-8(9-7)4-10(2)3/h7-9H,4-6H2,1-3H3/t7?,8-/m0/s1.
What are the key properties of N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine?
N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine has a molecular weight of 158.24 g/mol, XLogP of -0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(3S)-5-methylmorpholin-3-yl]methanamine is sourced from PubChem (CID 171530788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).