N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine

C13H26N4O — CID 10923093

IUPACN,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine
SMILESCN(C)CCCN=C=NCCCN1CCOCC1
InChIInChI=1S/C13H26N4O/c1-16(2)7-3-5-14-13-15-6-4-8-17-9-11-18-12-10-17/h3-12H2,1-2H3
InChIKeyQPXHBJHJPXJQMA-UHFFFAOYSA-N
MW254.38 g/mol
LogP0.83
Rot. Bonds8

About N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine

N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine (PubChem CID 10923093) has the molecular formula C13H26N4O and a molecular weight of 254.38 g/mol. Its IUPAC name is N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine
PubChem CID10923093
Molecular FormulaC13H26N4O
Molecular Weight254.38 g/mol
Exact Mass254.21
IUPAC NameN,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine
SMILESCN(C)CCCN=C=NCCCN1CCOCC1
InChIInChI=1S/C13H26N4O/c1-16(2)7-3-5-14-13-15-6-4-8-17-9-11-18-12-10-17/h3-12H2,1-2H3
InChIKeyQPXHBJHJPXJQMA-UHFFFAOYSA-N
XLogP0.83
TPSA40.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

zinc;N,N-dimethyl-2-morpholin-4-ylethanamine;dichloride
CID 70152362
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CID 28583738
3-(aziridin-1-yl)-N,N-dimethylpropan-1-amine
CID 154296752
N'-(3-morpholin-4-ylpropyl)propanimidamide
CID 63175512
N,N-dimethylpropan-1-amine;4-(4-methylpentyl)morpholine
CID 176932414
N-methyl-3-morpholin-4-yl-N-propylpropan-1-amine
CID 146735339
3-(2,2-dimethylpropyliminomethylideneamino)-N,N-dimethylpropan-1-amine
CID 174829721
N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine
CID 21030135
N-methyl-N'-(3-pyrrolidin-1-ylpropyl)methanediimine
CID 142643345
16-[10-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)decyl]-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 15145347
4-(4-methylpentyl)morpholine;N,N,2-trimethylpropan-1-amine
CID 142615810
N-methyl-N-(2-morpholin-4-ylethyl)-2-nitrosoethanamine
CID 174194198

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine?
The IUPAC name of N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine (CID 10923093) is N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine.
What is the SMILES notation for N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine?
The canonical SMILES for N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine is CN(C)CCCN=C=NCCCN1CCOCC1.
What is the InChIKey of N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine?
The InChIKey is QPXHBJHJPXJQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O/c1-16(2)7-3-5-14-13-15-6-4-8-17-9-11-18-12-10-17/h3-12H2,1-2H3.
What are the key properties of N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine?
N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine has a molecular weight of 254.38 g/mol, XLogP of 0.83, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(3-morpholin-4-ylpropyliminomethylideneamino)propan-1-amine is sourced from PubChem (CID 10923093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).