N-dimethylphosphoryl-N-propylpropan-1-amine

C8H20NOP — CID 154336648

IUPACN-dimethylphosphoryl-N-propylpropan-1-amine
SMILESCCCN(CCC)P(C)(C)=O
InChIInChI=1S/C8H20NOP/c1-5-7-9(8-6-2)11(3,4)10/h5-8H2,1-4H3
InChIKeyRZNXOYCFMPRDSZ-UHFFFAOYSA-N
MW177.23 g/mol
LogP2.65
Rot. Bonds5

About N-dimethylphosphoryl-N-propylpropan-1-amine

N-dimethylphosphoryl-N-propylpropan-1-amine (PubChem CID 154336648) has the molecular formula C8H20NOP and a molecular weight of 177.23 g/mol. Its IUPAC name is N-dimethylphosphoryl-N-propylpropan-1-amine.

Molecular Properties

Compound NameN-dimethylphosphoryl-N-propylpropan-1-amine
PubChem CID154336648
Molecular FormulaC8H20NOP
Molecular Weight177.23 g/mol
Exact Mass177.13
IUPAC NameN-dimethylphosphoryl-N-propylpropan-1-amine
SMILESCCCN(CCC)P(C)(C)=O
InChIInChI=1S/C8H20NOP/c1-5-7-9(8-6-2)11(3,4)10/h5-8H2,1-4H3
InChIKeyRZNXOYCFMPRDSZ-UHFFFAOYSA-N
XLogP2.65
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-dipropoxyphosphoryl-N-ethylpropan-1-amine
CID 24741650
N-[ethoxy(methoxy)phosphoryl]-N-propylpropan-1-amine
CID 86037664
N,N-bis(dimethylphosphoryl)ethanamine
CID 89318169
N-[[(dipropylamino)methyl-ethylphosphoryl]methyl]-N-propylpropan-1-amine
CID 3414475
bis(dibutylamino)phosphinic acid
CID 149434212
[2,4-dimethylpentan-3-yloxy-(dipropylamino)phosphoryl]formonitrile
CID 170850706
N-dimethoxyphosphoryl-N-methylpropan-1-amine
CID 22756487
azane;[phosphonomethyl(propyl)amino]methylphosphonic acid
CID 138397255
N-ethyl-N-methanidylpropan-1-amine
CID 59691637
N-ethyl-N-methanidylpropan-1-amine;yttrium
CID 165098751
N-(2-methoxyethyl)-N-propylformamide
CID 54522950
[2-(dipropylamino)-2-oxoethyl]phosphonic acid
CID 19906185

Frequently Asked Questions

What is the IUPAC name of N-dimethylphosphoryl-N-propylpropan-1-amine?
The IUPAC name of N-dimethylphosphoryl-N-propylpropan-1-amine (CID 154336648) is N-dimethylphosphoryl-N-propylpropan-1-amine.
What is the SMILES notation for N-dimethylphosphoryl-N-propylpropan-1-amine?
The canonical SMILES for N-dimethylphosphoryl-N-propylpropan-1-amine is CCCN(CCC)P(C)(C)=O.
What is the InChIKey of N-dimethylphosphoryl-N-propylpropan-1-amine?
The InChIKey is RZNXOYCFMPRDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20NOP/c1-5-7-9(8-6-2)11(3,4)10/h5-8H2,1-4H3.
What are the key properties of N-dimethylphosphoryl-N-propylpropan-1-amine?
N-dimethylphosphoryl-N-propylpropan-1-amine has a molecular weight of 177.23 g/mol, XLogP of 2.65, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-dimethylphosphoryl-N-propylpropan-1-amine is sourced from PubChem (CID 154336648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).