(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane

C9H20NP — CID 175635218

IUPAC(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane
SMILESCC(C)N1CCC(C)(P)CC1
InChIInChI=1S/C9H20NP/c1-8(2)10-6-4-9(3,11)5-7-10/h8H,4-7,11H2,1-3H3
InChIKeyNPBJGNVIABYFSF-UHFFFAOYSA-N
MW173.24 g/mol
LogP2.12
Rot. Bonds1

About (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane

(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane (PubChem CID 175635218) has the molecular formula C9H20NP and a molecular weight of 173.24 g/mol. Its IUPAC name is (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane.

Molecular Properties

Compound Name(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane
PubChem CID175635218
Molecular FormulaC9H20NP
Molecular Weight173.24 g/mol
Exact Mass173.13
IUPAC Name(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane
SMILESCC(C)N1CCC(C)(P)CC1
InChIInChI=1S/C9H20NP/c1-8(2)10-6-4-9(3,11)5-7-10/h8H,4-7,11H2,1-3H3
InChIKeyNPBJGNVIABYFSF-UHFFFAOYSA-N
XLogP2.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 52.12
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

8-propan-2-yl-8-azaspiro[4.5]deca-1,3-diene
CID 162769943
6-propan-2-yl-1,6-diazaspiro[2.5]octane
CID 58584452
1,4-di(propan-2-yl)piperidin-4-amine
CID 167417701
4-iodo-1-propan-2-ylpiperidin-4-amine
CID 155455763
3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine
CID 165121785
(4R,5S)-4,5-dimethyl-1-propan-2-ylazepan-4-ol
CID 174154195
1-propan-2-yl-4,4-dipropylpiperidine
CID 89468851
propan-2-one;6-propan-2-yl-6-azaspiro[2.5]octane
CID 170791695
6-propan-2-yl-1,6-diazaspiro[2.4]heptane
CID 155640500
ethane;7-propan-2-yl-2-oxa-7-azaspiro[3.5]nonane
CID 163266549
ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine
CID 170571754
ethane;2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decane
CID 177025738

Frequently Asked Questions

What is the IUPAC name of (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane?
The IUPAC name of (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane (CID 175635218) is (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane.
What is the SMILES notation for (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane?
The canonical SMILES for (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane is CC(C)N1CCC(C)(P)CC1.
What is the InChIKey of (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane?
The InChIKey is NPBJGNVIABYFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20NP/c1-8(2)10-6-4-9(3,11)5-7-10/h8H,4-7,11H2,1-3H3.
What are the key properties of (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane?
(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane has a molecular weight of 173.24 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane is sourced from PubChem (CID 175635218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).