N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine

C16H33N3O — CID 61211177

IUPACN,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine
SMILESCC1CCCC(CNCCN2CCOCC2)(N(C)C)C1
InChIInChI=1S/C16H33N3O/c1-15-5-4-6-16(13-15,18(2)3)14-17-7-8-19-9-11-20-12-10-19/h15,17H,4-14H2,1-3H3
InChIKeyYBPGKBVYMUXPGK-UHFFFAOYSA-N
MW283.46 g/mol
LogP1.42
Rot. Bonds6

About N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine

N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine (PubChem CID 61211177) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine
PubChem CID61211177
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine
SMILESCC1CCCC(CNCCN2CCOCC2)(N(C)C)C1
InChIInChI=1S/C16H33N3O/c1-15-5-4-6-16(13-15,18(2)3)14-17-7-8-19-9-11-20-12-10-19/h15,17H,4-14H2,1-3H3
InChIKeyYBPGKBVYMUXPGK-UHFFFAOYSA-N
XLogP1.42
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1-(3-morpholin-4-ylpropyl)guanidine
CID 111077161
N,N,3-trimethyl-1-[(oxolan-3-ylmethylamino)methyl]cyclohexan-1-amine
CID 61211546
2-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-1-ethyl-3-(3-morpholin-4-ylpropyl)guanidine
CID 110973059
N,N,3-trimethyl-1-[(2-propan-2-yloxyethylamino)methyl]cyclohexan-1-amine
CID 54957909
N,N,3-trimethyl-1-[(oxolan-2-ylmethylamino)methyl]cyclohexan-1-amine
CID 61212304
N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]oxetan-3-amine
CID 63622541
N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]oxolan-3-amine
CID 55202503
N,N,3-trimethyl-1-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]cyclohexan-1-amine
CID 61490311
1-(aminomethyl)-3-methyl-N-(2-morpholin-4-ylethyl)-N-propylcyclohexan-1-amine
CID 62007321
1-amino-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexane-1-carboxamide
CID 64548791
N,N,3-trimethyl-1-[[(1-methylpyrazol-4-yl)methylamino]methyl]cyclohexan-1-amine
CID 61212484
5-[[1-(dimethylamino)-3-methylcyclohexyl]methylamino]-N'-hydroxypentanimidamide
CID 77031819

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine?
The IUPAC name of N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine (CID 61211177) is N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine.
What is the SMILES notation for N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine?
The canonical SMILES for N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine is CC1CCCC(CNCCN2CCOCC2)(N(C)C)C1.
What is the InChIKey of N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine?
The InChIKey is YBPGKBVYMUXPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-15-5-4-6-16(13-15,18(2)3)14-17-7-8-19-9-11-20-12-10-19/h15,17H,4-14H2,1-3H3.
What are the key properties of N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine?
N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine has a molecular weight of 283.46 g/mol, XLogP of 1.42, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-1-[(2-morpholin-4-ylethylamino)methyl]cyclohexan-1-amine is sourced from PubChem (CID 61211177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).