N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine

C9H22NP — CID 22213688

IUPACN,N,2,4-tetramethyl-3-phosphanylpentan-3-amine
SMILESCC(C)C(P)(C(C)C)N(C)C
InChIInChI=1S/C9H22NP/c1-7(2)9(11,8(3)4)10(5)6/h7-8H,11H2,1-6H3
InChIKeyBHYIEGIVOXRGLD-UHFFFAOYSA-N
MW175.26 g/mol
LogP2.43
Rot. Bonds3

About N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine

N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine (PubChem CID 22213688) has the molecular formula C9H22NP and a molecular weight of 175.26 g/mol. Its IUPAC name is N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine.

Molecular Properties

Compound NameN,N,2,4-tetramethyl-3-phosphanylpentan-3-amine
PubChem CID22213688
Molecular FormulaC9H22NP
Molecular Weight175.26 g/mol
Exact Mass175.15
IUPAC NameN,N,2,4-tetramethyl-3-phosphanylpentan-3-amine
SMILESCC(C)C(P)(C(C)C)N(C)C
InChIInChI=1S/C9H22NP/c1-7(2)9(11,8(3)4)10(5)6/h7-8H,11H2,1-6H3
InChIKeyBHYIEGIVOXRGLD-UHFFFAOYSA-N
XLogP2.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.26
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine?
The IUPAC name of N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine (CID 22213688) is N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine.
What is the SMILES notation for N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine?
The canonical SMILES for N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine is CC(C)C(P)(C(C)C)N(C)C.
What is the InChIKey of N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine?
The InChIKey is BHYIEGIVOXRGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NP/c1-7(2)9(11,8(3)4)10(5)6/h7-8H,11H2,1-6H3.
What are the key properties of N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine?
N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine has a molecular weight of 175.26 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,4-tetramethyl-3-phosphanylpentan-3-amine is sourced from PubChem (CID 22213688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).