4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide

C10H20N2O — CID 114486997

IUPAC4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide
SMILESCCC1(C(C)C)CNCC1C(N)=O
InChIInChI=1S/C10H20N2O/c1-4-10(7(2)3)6-12-5-8(10)9(11)13/h7-8,12H,4-6H2,1-3H3,(H2,11,13)
InChIKeySKMHCKROMCWJIQ-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.74
Rot. Bonds3

About 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide

4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide (PubChem CID 114486997) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide
PubChem CID114486997
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide
SMILESCCC1(C(C)C)CNCC1C(N)=O
InChIInChI=1S/C10H20N2O/c1-4-10(7(2)3)6-12-5-8(10)9(11)13/h7-8,12H,4-6H2,1-3H3,(H2,11,13)
InChIKeySKMHCKROMCWJIQ-UHFFFAOYSA-N
XLogP0.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

8-propan-2-yl-2-azaspiro[4.5]decane-4-carboxamide
CID 114486977
4-(cyclopropylmethyl)-4-methylpyrrolidine-3-carboxamide
CID 114486950
4-cyclopropyl-4-methylpyrrolidine-3-carboxamide
CID 114486962
8-ethyl-2-azaspiro[4.4]nonane-4-carboxamide
CID 114487091
4,4-diethylpyrrolidine-3-carboxylic acid
CID 63939611
4-ethyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 114486964
4-ethyl-4-(2-methylbutyl)pyrrolidine-3-carboxylic acid
CID 63940379
6,9-dimethyl-2-azaspiro[4.5]decane-4-carboxamide
CID 114486982
7,7,9-trimethyl-2-azaspiro[4.5]decane-4-carboxamide
CID 114487107
ethyl (3R,4R)-4-methyl-4-phenylpyrrolidine-3-carboxylate
CID 97357628
ethyl 4-ethyl-4-(4-methylphenyl)pyrrolidine-3-carboxylate
CID 114486738
ethyl 4-methyl-4-pyridin-4-ylpyrrolidine-3-carboxylate
CID 114486700

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide?
The IUPAC name of 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide (CID 114486997) is 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide?
The canonical SMILES for 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide is CCC1(C(C)C)CNCC1C(N)=O.
What is the InChIKey of 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide?
The InChIKey is SKMHCKROMCWJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-10(7(2)3)6-12-5-8(10)9(11)13/h7-8,12H,4-6H2,1-3H3,(H2,11,13).
What are the key properties of 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide?
4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4-propan-2-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 114486997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).