1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine

C10H25N2P — CID 12782593

IUPAC1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine
SMILESCN(C)CP(CN(C)C)C(C)(C)C
InChIInChI=1S/C10H25N2P/c1-10(2,3)13(8-11(4)5)9-12(6)7/h8-9H2,1-7H3
InChIKeyXFNQZWOFQDOUMM-UHFFFAOYSA-N
MW204.30 g/mol
LogP2.31
Rot. Bonds4

About 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine

1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine (PubChem CID 12782593) has the molecular formula C10H25N2P and a molecular weight of 204.30 g/mol. Its IUPAC name is 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine
PubChem CID12782593
Molecular FormulaC10H25N2P
Molecular Weight204.30 g/mol
Exact Mass204.18
IUPAC Name1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine
SMILESCN(C)CP(CN(C)C)C(C)(C)C
InChIInChI=1S/C10H25N2P/c1-10(2,3)13(8-11(4)5)9-12(6)7/h8-9H2,1-7H3
InChIKeyXFNQZWOFQDOUMM-UHFFFAOYSA-N
XLogP2.31
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine (CID 12782593) is 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine is CN(C)CP(CN(C)C)C(C)(C)C.
What is the InChIKey of 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine?
The InChIKey is XFNQZWOFQDOUMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N2P/c1-10(2,3)13(8-11(4)5)9-12(6)7/h8-9H2,1-7H3.
What are the key properties of 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine?
1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine has a molecular weight of 204.30 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[tert-butyl-[(dimethylamino)methyl]phosphanyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 12782593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).