2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride

C10H19ClN2O — CID 130978633

IUPAC2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride
SMILESCC(N)C(=O)N1CCCC1C1CC1.Cl
InChIInChI=1S/C10H18N2O.ClH/c1-7(11)10(13)12-6-2-3-9(12)8-4-5-8;/h7-9H,2-6,11H2,1H3;1H
InChIKeyONLBWFOCNRZJKS-UHFFFAOYSA-N
MW218.73 g/mol
LogP1.16
Rot. Bonds2

About 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride

2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride (PubChem CID 130978633) has the molecular formula C10H19ClN2O and a molecular weight of 218.73 g/mol. Its IUPAC name is 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride
PubChem CID130978633
Molecular FormulaC10H19ClN2O
Molecular Weight218.73 g/mol
Exact Mass218.12
IUPAC Name2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride
SMILESCC(N)C(=O)N1CCCC1C1CC1.Cl
InChIInChI=1S/C10H18N2O.ClH/c1-7(11)10(13)12-6-2-3-9(12)8-4-5-8;/h7-9H,2-6,11H2,1H3;1H
InChIKeyONLBWFOCNRZJKS-UHFFFAOYSA-N
XLogP1.16
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.73
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-1-(2-cyclopentylpyrrolidin-1-yl)propan-1-one;hydrochloride
CID 119300932
(2S)-1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-amino-3-methylbutan-1-one
CID 65320801
2-amino-1-(6-azabicyclo[3.2.0]heptan-6-yl)propan-1-one
CID 130734923
1-(2-cyclohexylpyrrolidin-1-yl)-2-methylpropan-1-one
CID 61063339
1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-sulfanylpropan-1-one
CID 107031197
(2S)-1-[(5aR,8aR)-2,3,5,5a,6,7,8,8a-octahydrocyclopenta[e][1,4]oxazepin-1-yl]-2-aminopropan-1-one
CID 129498922
(2S,3S)-1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-amino-3-methylpentan-1-one
CID 102726137
(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 12718469
2-amino-1-(2-cyclopentylpyrrolidin-1-yl)-3-methoxypropan-1-one
CID 81088765
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-methyl-3-oxopropanoic acid
CID 114897399
2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one
CID 62123034
(2R)-1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid
CID 23423034

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride?
The IUPAC name of 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride (CID 130978633) is 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride.
What is the SMILES notation for 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride?
The canonical SMILES for 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride is CC(N)C(=O)N1CCCC1C1CC1.Cl.
What is the InChIKey of 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride?
The InChIKey is ONLBWFOCNRZJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O.ClH/c1-7(11)10(13)12-6-2-3-9(12)8-4-5-8;/h7-9H,2-6,11H2,1H3;1H.
What are the key properties of 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride?
2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride has a molecular weight of 218.73 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride is sourced from PubChem (CID 130978633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).