4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide

C8H16N2O2 — CID 174968464

IUPAC4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide
SMILESNCCC(O)C(=O)NCC1CC1
InChIInChI=1S/C8H16N2O2/c9-4-3-7(11)8(12)10-5-6-1-2-6/h6-7,11H,1-5,9H2,(H,10,12)
InChIKeyKXQIBCPDNGNYPD-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.78
Rot. Bonds5

About 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide

4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide (PubChem CID 174968464) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide.

Molecular Properties

Compound Name4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide
PubChem CID174968464
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide
SMILESNCCC(O)C(=O)NCC1CC1
InChIInChI=1S/C8H16N2O2/c9-4-3-7(11)8(12)10-5-6-1-2-6/h6-7,11H,1-5,9H2,(H,10,12)
InChIKeyKXQIBCPDNGNYPD-UHFFFAOYSA-N
XLogP-0.78
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(cyclobutylmethyl)-2-hydroxypropanamide
CID 115180610
4-amino-N-[(4-ethylcyclohexyl)methyl]-2-methylbutanamide
CID 80543097
4-[[(4-amino-2-methylbutanoyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 80545198
N-(cyclopropylmethyl)-2-hydroxypropanamide
CID 131088894
2-amino-N-(cyclopropylmethyl)propanamide
CID 24690233
(2S)-2-amino-N-(cyclopropylmethyl)-3-hydroxypropanamide
CID 70262272
4-amino-N-[(1-ethylpiperidin-4-yl)methyl]-2-methylbutanamide
CID 80543737
5-amino-N-(cyclohexylmethyl)-2-methylpentanamide
CID 104683632
2-[4-aminobutan-2-yl(methyl)amino]-N-(cyclopropylmethyl)acetamide
CID 63225580
2-(aminomethyl)-N-[(4-hydroxycyclohexyl)methyl]pentanamide
CID 106135811
(2S)-2-amino-N-[(4-ethylcyclohexyl)methyl]pentanamide
CID 93389393
(2S)-2-amino-N-[(4-ethylcyclohexyl)methyl]propanamide
CID 61149083

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide?
The IUPAC name of 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide (CID 174968464) is 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide.
What is the SMILES notation for 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide?
The canonical SMILES for 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide is NCCC(O)C(=O)NCC1CC1.
What is the InChIKey of 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide?
The InChIKey is KXQIBCPDNGNYPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c9-4-3-7(11)8(12)10-5-6-1-2-6/h6-7,11H,1-5,9H2,(H,10,12).
What are the key properties of 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide?
4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide has a molecular weight of 172.23 g/mol, XLogP of -0.78, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(cyclopropylmethyl)-2-hydroxybutanamide is sourced from PubChem (CID 174968464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).