N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide

C9H18N2O2 — CID 63297635

IUPACN-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide
SMILESCNCCC(=O)NCC(O)C1CC1
InChIInChI=1S/C9H18N2O2/c1-10-5-4-9(13)11-6-8(12)7-2-3-7/h7-8,10,12H,2-6H2,1H3,(H,11,13)
InChIKeyOJEZPNDKWZELGD-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.52
Rot. Bonds6

About N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide

N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide (PubChem CID 63297635) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide
PubChem CID63297635
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide
SMILESCNCCC(=O)NCC(O)C1CC1
InChIInChI=1S/C9H18N2O2/c1-10-5-4-9(13)11-6-8(12)7-2-3-7/h7-8,10,12H,2-6H2,1H3,(H,11,13)
InChIKeyOJEZPNDKWZELGD-UHFFFAOYSA-N
XLogP-0.52
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-cyclopropyl-2-hydroxyethyl)propanamide
CID 63297161
N-(2-cyclopropyl-2-hydroxyethyl)-4-(propan-2-ylamino)butanamide
CID 63297357
N-(2-cyclopropyl-2-hydroxyethyl)nonanamide
CID 63294974
N-(2-cyclopropyl-2-hydroxyethyl)pent-4-ynamide
CID 107358903
N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)acetamide
CID 63296919
N-(2-cyclopropyl-2-hydroxyethyl)-2-(2-methoxyethylamino)acetamide
CID 79280826
N-(2-cyclopentyl-2-hydroxyethyl)-3-ethoxypropanamide
CID 111425977
3-amino-N-(2-cyclohexyl-2-hydroxyethyl)propanamide;hydrochloride
CID 119293866
N-(2-cyclopentyl-2-hydroxyethyl)-3-methylbutanamide
CID 111425656
3-(methylamino)-N-[2-(methylamino)ethyl]propanamide
CID 59688102
N-(2-cyclopropyl-2-hydroxyethyl)-2-ethylbutanamide
CID 63294520
3-cyclopentyl-N-[2-[(2-cyclopentyl-2-hydroxyethyl)amino]-2-oxoethyl]propanamide
CID 111426276

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide?
The IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide (CID 63297635) is N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide.
What is the SMILES notation for N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide?
The canonical SMILES for N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide is CNCCC(=O)NCC(O)C1CC1.
What is the InChIKey of N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide?
The InChIKey is OJEZPNDKWZELGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-10-5-4-9(13)11-6-8(12)7-2-3-7/h7-8,10,12H,2-6H2,1H3,(H,11,13).
What are the key properties of N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide?
N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide has a molecular weight of 186.25 g/mol, XLogP of -0.52, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide is sourced from PubChem (CID 63297635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).