methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide

C10H22N2O — CID 143936298

IUPACmethane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide
SMILESC.CC(C)C1CC(NC=O)CN1C
InChIInChI=1S/C9H18N2O.CH4/c1-7(2)9-4-8(10-6-12)5-11(9)3;/h6-9H,4-5H2,1-3H3,(H,10,12);1H4
InChIKeyGHAZCRJIFWNJHR-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.10
Rot. Bonds3

About methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide

methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide (PubChem CID 143936298) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide.

Molecular Properties

Compound Namemethane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide
PubChem CID143936298
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Namemethane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide
SMILESC.CC(C)C1CC(NC=O)CN1C
InChIInChI=1S/C9H18N2O.CH4/c1-7(2)9-4-8(10-6-12)5-11(9)3;/h6-9H,4-5H2,1-3H3,(H,10,12);1H4
InChIKeyGHAZCRJIFWNJHR-UHFFFAOYSA-N
XLogP1.10
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide?
The IUPAC name of methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide (CID 143936298) is methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide.
What is the SMILES notation for methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide?
The canonical SMILES for methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide is C.CC(C)C1CC(NC=O)CN1C.
What is the InChIKey of methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide?
The InChIKey is GHAZCRJIFWNJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O.CH4/c1-7(2)9-4-8(10-6-12)5-11(9)3;/h6-9H,4-5H2,1-3H3,(H,10,12);1H4.
What are the key properties of methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide?
methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide has a molecular weight of 186.30 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;N-(1-methyl-5-propan-2-ylpyrrolidin-3-yl)formamide is sourced from PubChem (CID 143936298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).