N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine

C15H27N2P — CID 101447690

IUPACN-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine
SMILESCN(CP(C(C)(C)C)C(C)(C)C)c1ccccn1
InChIInChI=1S/C15H27N2P/c1-14(2,3)18(15(4,5)6)12-17(7)13-10-8-9-11-16-13/h8-11H,12H2,1-7H3
InChIKeyAECQQHDFNLEVOM-UHFFFAOYSA-N
MW266.37 g/mol
LogP4.55
Rot. Bonds3

About N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine

N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine (PubChem CID 101447690) has the molecular formula C15H27N2P and a molecular weight of 266.37 g/mol. Its IUPAC name is N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine
PubChem CID101447690
Molecular FormulaC15H27N2P
Molecular Weight266.37 g/mol
Exact Mass266.19
IUPAC NameN-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine
SMILESCN(CP(C(C)(C)C)C(C)(C)C)c1ccccn1
InChIInChI=1S/C15H27N2P/c1-14(2,3)18(15(4,5)6)12-17(7)13-10-8-9-11-16-13/h8-11H,12H2,1-7H3
InChIKeyAECQQHDFNLEVOM-UHFFFAOYSA-N
XLogP4.55
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N-methylpyridin-2-amine;hydrochloride
CID 175013921
ethane;N'-methyl-N'-pyridin-2-ylmethanediamine
CID 91614077
N-methyl-N-propylpyridin-2-amine;hydrochloride
CID 69422308
N-methyl-N-pyridin-2-ylpyridin-2-amine
CID 14365053
N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridin-2-amine
CID 60921940
3-[methyl(pyridin-2-yl)amino]propan-1-ol
CID 57466357
N'-methyl-N'-pyridin-2-ylpropane-1,3-diamine;dihydrochloride
CID 134690924
4-[methyl(pyridin-2-yl)amino]butan-1-ol
CID 115217548
2-[methyl(pyridin-2-yl)amino]acetic acid;hydrochloride
CID 71627035
N,N-dimethylpyridin-2-amine;molecular hydrogen
CID 143283394
4-[methyl(pyridin-2-yl)amino]butanenitrile
CID 115231630
2-ethyl-N'-methyl-N'-pyridin-2-ylpropane-1,3-diamine
CID 115251395

Frequently Asked Questions

What is the IUPAC name of N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine?
The IUPAC name of N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine (CID 101447690) is N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine.
What is the SMILES notation for N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine?
The canonical SMILES for N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine is CN(CP(C(C)(C)C)C(C)(C)C)c1ccccn1.
What is the InChIKey of N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine?
The InChIKey is AECQQHDFNLEVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N2P/c1-14(2,3)18(15(4,5)6)12-17(7)13-10-8-9-11-16-13/h8-11H,12H2,1-7H3.
What are the key properties of N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine?
N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine has a molecular weight of 266.37 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ditert-butylphosphanylmethyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 101447690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).