(2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide

C7H14N2O2 — CID 79026243

IUPAC(2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide
SMILESC[C@H](N)C(=O)NC1CC(O)C1
InChIInChI=1S/C7H14N2O2/c1-4(8)7(11)9-5-2-6(10)3-5/h4-6,10H,2-3,8H2,1H3,(H,9,11)/t4-,5?,6?/m0/s1
InChIKeyXUDWKYISKHJNMT-KXGSVCODSA-N
MW158.20 g/mol
LogP-1.03
Rot. Bonds2

About (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide

(2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide (PubChem CID 79026243) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide
PubChem CID79026243
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name(2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide
SMILESC[C@H](N)C(=O)NC1CC(O)C1
InChIInChI=1S/C7H14N2O2/c1-4(8)7(11)9-5-2-6(10)3-5/h4-6,10H,2-3,8H2,1H3,(H,9,11)/t4-,5?,6?/m0/s1
InChIKeyXUDWKYISKHJNMT-KXGSVCODSA-N
XLogP-1.03
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-1.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide?
The IUPAC name of (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide (CID 79026243) is (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide is C[C@H](N)C(=O)NC1CC(O)C1.
What is the InChIKey of (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide?
The InChIKey is XUDWKYISKHJNMT-KXGSVCODSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-4(8)7(11)9-5-2-6(10)3-5/h4-6,10H,2-3,8H2,1H3,(H,9,11)/t4-,5?,6?/m0/s1.
What are the key properties of (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide?
(2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide has a molecular weight of 158.20 g/mol, XLogP of -1.03, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide is sourced from PubChem (CID 79026243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).