(2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide

C8H16N2O — CID 126982180

IUPAC(2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide
SMILESCN[C@@H](C)C(=O)NC1CC1C
InChIInChI=1S/C8H16N2O/c1-5-4-7(5)10-8(11)6(2)9-3/h5-7,9H,4H2,1-3H3,(H,10,11)/t5?,6-,7?/m0/s1
InChIKeyXMUWPIRPQKTFID-HUDPQJTASA-N
MW156.23 g/mol
LogP0.12
Rot. Bonds3

About (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide

(2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide (PubChem CID 126982180) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide
PubChem CID126982180
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide
SMILESCN[C@@H](C)C(=O)NC1CC1C
InChIInChI=1S/C8H16N2O/c1-5-4-7(5)10-8(11)6(2)9-3/h5-7,9H,4H2,1-3H3,(H,10,11)/t5?,6-,7?/m0/s1
InChIKeyXMUWPIRPQKTFID-HUDPQJTASA-N
XLogP0.12
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide?
The IUPAC name of (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide (CID 126982180) is (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide.
What is the SMILES notation for (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide?
The canonical SMILES for (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide is CN[C@@H](C)C(=O)NC1CC1C.
What is the InChIKey of (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide?
The InChIKey is XMUWPIRPQKTFID-HUDPQJTASA-N. The full InChI is InChI=1S/C8H16N2O/c1-5-4-7(5)10-8(11)6(2)9-3/h5-7,9H,4H2,1-3H3,(H,10,11)/t5?,6-,7?/m0/s1.
What are the key properties of (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide?
(2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide has a molecular weight of 156.23 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(methylamino)-N-(2-methylcyclopropyl)propanamide is sourced from PubChem (CID 126982180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).