5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide

C12H24N2O2 — CID 82011608

IUPAC5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide
SMILESCC(CN)CCC(=O)NCCC1CCCO1
InChIInChI=1S/C12H24N2O2/c1-10(9-13)4-5-12(15)14-7-6-11-3-2-8-16-11/h10-11H,2-9,13H2,1H3,(H,14,15)
InChIKeyCYKBRZSHWXJMMP-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.05
Rot. Bonds7

About 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide

5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide (PubChem CID 82011608) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide.

Molecular Properties

Compound Name5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide
PubChem CID82011608
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide
SMILESCC(CN)CCC(=O)NCCC1CCCO1
InChIInChI=1S/C12H24N2O2/c1-10(9-13)4-5-12(15)14-7-6-11-3-2-8-16-11/h10-11H,2-9,13H2,1H3,(H,14,15)
InChIKeyCYKBRZSHWXJMMP-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 79192350
methyl 4-oxo-4-[2-(oxolan-2-yl)ethylamino]butanoate
CID 110731234
3-(tert-butylamino)-N-[2-(oxolan-2-yl)ethyl]propanamide
CID 54917416
3-oxo-3-[2-(oxolan-2-yl)ethylamino]propanoic acid
CID 62230104
3-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 62837285
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 107569103
(2R)-2-amino-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 103794477
N-(2-hydroxyethyl)-3-(oxolan-2-yl)propanamide
CID 43419593
N-(2-chloropropyl)-3-(oxolan-2-yl)propanamide
CID 114296653
N-[(2S)-2-hydroxypropyl]-3-[(2R)-oxolan-2-yl]propanamide
CID 93044550
3-(oxolan-2-yl)-N-(3-propan-2-yloxypropyl)propanamide
CID 86930166
2-ethyl-N-[2-(oxolan-2-yl)ethyl]butanamide
CID 110731236

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide?
The IUPAC name of 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide (CID 82011608) is 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide.
What is the SMILES notation for 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide?
The canonical SMILES for 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide is CC(CN)CCC(=O)NCCC1CCCO1.
What is the InChIKey of 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide?
The InChIKey is CYKBRZSHWXJMMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-10(9-13)4-5-12(15)14-7-6-11-3-2-8-16-11/h10-11H,2-9,13H2,1H3,(H,14,15).
What are the key properties of 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide?
5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide has a molecular weight of 228.34 g/mol, XLogP of 1.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]pentanamide is sourced from PubChem (CID 82011608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).