3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide

C12H26N2O2 — CID 103820610

IUPAC3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide
SMILESCCCC(CCO)CNC(=O)CCN(C)C
InChIInChI=1S/C12H26N2O2/c1-4-5-11(7-9-15)10-13-12(16)6-8-14(2)3/h11,15H,4-10H2,1-3H3,(H,13,16)
InChIKeyVZGMBVZCHBWPBW-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.85
Rot. Bonds9

About 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide

3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide (PubChem CID 103820610) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide
PubChem CID103820610
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide
SMILESCCCC(CCO)CNC(=O)CCN(C)C
InChIInChI=1S/C12H26N2O2/c1-4-5-11(7-9-15)10-13-12(16)6-8-14(2)3/h11,15H,4-10H2,1-3H3,(H,13,16)
InChIKeyVZGMBVZCHBWPBW-UHFFFAOYSA-N
XLogP0.85
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-hydroxyethyl)pentyl]pent-4-ynamide
CID 106115864
3-(tert-butylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide
CID 114145527
N-[2-(2-hydroxyethyl)pentyl]-2-(methylamino)acetamide;hydrochloride
CID 120704813
N-[2-(2-hydroxyethyl)pentyl]-2-methylsulfanylacetamide
CID 103722907
3-cyclopentyl-N-[2-(2-hydroxyethyl)pentyl]propanamide
CID 113248441
3,3,3-trifluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide
CID 103725598
N-[2-(2-hydroxyethyl)pentyl]-3-phenylpropanamide
CID 103722786
3-(dimethylamino)-N-[(11Z,14Z)-2-[(Z)-heptadec-9-enyl]icosa-11,14-dienyl]propanamide
CID 130459049
1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea
CID 103708339
3-(4-aminophenoxy)-N-[2-(2-hydroxyethyl)pentyl]propanamide
CID 106113357
2-tert-butylsulfanyl-N-[2-(2-hydroxyethyl)pentyl]acetamide
CID 113248427
3-amino-N-[2-(2-hydroxyethyl)pentyl]-4-methylpentanamide
CID 106116641

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide?
The IUPAC name of 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide (CID 103820610) is 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide.
What is the SMILES notation for 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide?
The canonical SMILES for 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide is CCCC(CCO)CNC(=O)CCN(C)C.
What is the InChIKey of 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide?
The InChIKey is VZGMBVZCHBWPBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-4-5-11(7-9-15)10-13-12(16)6-8-14(2)3/h11,15H,4-10H2,1-3H3,(H,13,16).
What are the key properties of 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide?
3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide has a molecular weight of 230.35 g/mol, XLogP of 0.85, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[2-(2-hydroxyethyl)pentyl]propanamide is sourced from PubChem (CID 103820610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).