N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine

C13H24N2O — CID 171540310

IUPACN-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine
SMILESCC1C=C1CN(C)CCCN1CCOCC1
InChIInChI=1S/C13H24N2O/c1-12-10-13(12)11-14(2)4-3-5-15-6-8-16-9-7-15/h10,12H,3-9,11H2,1-2H3
InChIKeyWSIBOSWHEIKXHK-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.22
Rot. Bonds6

About N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine

N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine (PubChem CID 171540310) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound NameN-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine
PubChem CID171540310
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine
SMILESCC1C=C1CN(C)CCCN1CCOCC1
InChIInChI=1S/C13H24N2O/c1-12-10-13(12)11-14(2)4-3-5-15-6-8-16-9-7-15/h10,12H,3-9,11H2,1-2H3
InChIKeyWSIBOSWHEIKXHK-UHFFFAOYSA-N
XLogP1.22
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-3-morpholin-4-yl-N-propylpropan-1-amine
CID 146735339
3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid
CID 82328722
2-methyl-1-[methyl(3-morpholin-4-ylpropyl)amino]propan-2-ol
CID 111488087
N'-benzyl-N'-methyl-N-(2-morpholin-4-ylethyl)propane-1,3-diamine
CID 28577606
N-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 67379055
4-[methyl(2-morpholin-4-ylethyl)amino]cyclohexan-1-one
CID 79120517
N-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 123906232
3-(7,13-diethyl-1,4-dioxa-7,10,13-triazacyclopentadec-10-yl)-N,N-diethylpropan-1-amine
CID 14661126
1-[4-[[methyl(3-morpholin-4-ylpropyl)amino]methyl]piperidin-1-yl]propan-2-ol
CID 71925951
(2R)-1-[4-[[methyl(3-morpholin-4-ylpropyl)amino]methyl]piperidin-1-yl]propan-2-ol
CID 97087148
(2S)-N,2-dimethyl-N-(4-morpholin-4-ylbutyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 126443915
N-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-3-morpholin-4-ylpropan-1-amine
CID 26399798

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine?
The IUPAC name of N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine (CID 171540310) is N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine?
The canonical SMILES for N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine is CC1C=C1CN(C)CCCN1CCOCC1.
What is the InChIKey of N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine?
The InChIKey is WSIBOSWHEIKXHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-12-10-13(12)11-14(2)4-3-5-15-6-8-16-9-7-15/h10,12H,3-9,11H2,1-2H3.
What are the key properties of N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine?
N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine has a molecular weight of 224.35 g/mol, XLogP of 1.22, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 171540310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).