2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine

C8H18NP — CID 142059806

IUPAC2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine
SMILESC=CC(C)(C)C(C)(C)NP
InChIInChI=1S/C8H18NP/c1-6-7(2,3)8(4,5)9-10/h6,9H,1,10H2,2-5H3
InChIKeyPPBXRKUWNACNKN-UHFFFAOYSA-N
MW159.21 g/mol
LogP2.36
Rot. Bonds3

About 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine

2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine (PubChem CID 142059806) has the molecular formula C8H18NP and a molecular weight of 159.21 g/mol. Its IUPAC name is 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine.

Molecular Properties

Compound Name2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine
PubChem CID142059806
Molecular FormulaC8H18NP
Molecular Weight159.21 g/mol
Exact Mass159.12
IUPAC Name2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine
SMILESC=CC(C)(C)C(C)(C)NP
InChIInChI=1S/C8H18NP/c1-6-7(2,3)8(4,5)9-10/h6,9H,1,10H2,2-5H3
InChIKeyPPBXRKUWNACNKN-UHFFFAOYSA-N
XLogP2.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.21
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,3,4,4,5,5,6,6,7,7,8,8,9,9-tetradecamethylundeca-1,10-diene
CID 162304109
2,3,3-trimethylpent-4-en-2-ylsilane
CID 175326374
3,3,4,4,5-pentamethylhex-1-ene
CID 23384855
3,3-difluoro-4,4-dimethylhex-5-en-2-one
CID 11084183
3,3-dimethylbut-1-ene;2,2-dimethylpropane
CID 162278792
ethene;bis(2,2,5,5-tetramethylhex-3-ene)
CID 162279391
3,3-difluorobut-1-ene;propane
CID 143721745
ethene;1,1,1-trifluoroethane
CID 175131333
3-methanidyl-3-methylbut-1-ene
CID 91253785
azane;2-methyl-N-prop-2-enylbut-3-en-2-amine;hydrochloride
CID 175381941
(3S)-4,4-dimethyl-3-(phosphanylamino)hex-5-en-2-one
CID 121323798
2-ethyl-2,3,3-trimethylpent-4-enal
CID 145209008

Frequently Asked Questions

What is the IUPAC name of 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine?
The IUPAC name of 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine (CID 142059806) is 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine.
What is the SMILES notation for 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine?
The canonical SMILES for 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine is C=CC(C)(C)C(C)(C)NP.
What is the InChIKey of 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine?
The InChIKey is PPBXRKUWNACNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18NP/c1-6-7(2,3)8(4,5)9-10/h6,9H,1,10H2,2-5H3.
What are the key properties of 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine?
2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine has a molecular weight of 159.21 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trimethyl-N-phosphanylpent-4-en-2-amine is sourced from PubChem (CID 142059806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).