[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride

C10H20ClN3O — CID 130762786

IUPAC[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride
SMILESCC1CC(CN)CN1C(=O)C1CNC1.Cl
InChIInChI=1S/C10H19N3O.ClH/c1-7-2-8(3-11)6-13(7)10(14)9-4-12-5-9;/h7-9,12H,2-6,11H2,1H3;1H
InChIKeyMFYGQFKRCQOBGC-UHFFFAOYSA-N
MW233.74 g/mol
LogP-0.18
Rot. Bonds2

About [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride

[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride (PubChem CID 130762786) has the molecular formula C10H20ClN3O and a molecular weight of 233.74 g/mol. Its IUPAC name is [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride.

Molecular Properties

Compound Name[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride
PubChem CID130762786
Molecular FormulaC10H20ClN3O
Molecular Weight233.74 g/mol
Exact Mass233.13
IUPAC Name[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride
SMILESCC1CC(CN)CN1C(=O)C1CNC1.Cl
InChIInChI=1S/C10H19N3O.ClH/c1-7-2-8(3-11)6-13(7)10(14)9-4-12-5-9;/h7-9,12H,2-6,11H2,1H3;1H
InChIKeyMFYGQFKRCQOBGC-UHFFFAOYSA-N
XLogP-0.18
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 104856469
1-[4-(aminomethyl)-2-methylpyrrolidin-1-yl]but-2-yn-1-one
CID 107990772
[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(oxan-2-yl)methanone
CID 115491882
[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(1H-pyrrol-2-yl)methanone
CID 115491771
1-[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-2-ethylhexan-1-one
CID 113322450
[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(2,3-dichlorophenyl)methanone
CID 115491945
1-[4-(aminomethyl)cyclohexanecarbonyl]-2-methylpiperidine-4-carboxylic acid
CID 106742867
2-adamantyl-[5-(aminomethyl)-2-methylpiperidin-1-yl]methanone
CID 81100565
(E)-1-[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-3-(4-chlorophenyl)prop-2-en-1-one
CID 115491830
azetidin-3-yl-(3-methylazetidin-1-yl)methanone
CID 164653902
[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(1,3-dimethylpyrazol-4-yl)methanone
CID 103840438
3-amino-N-[[1-(azetidine-3-carbonyl)piperidin-2-yl]methyl]propanamide;dihydrochloride
CID 122084349

Frequently Asked Questions

What is the IUPAC name of [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride?
The IUPAC name of [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride (CID 130762786) is [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride.
What is the SMILES notation for [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride?
The canonical SMILES for [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride is CC1CC(CN)CN1C(=O)C1CNC1.Cl.
What is the InChIKey of [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride?
The InChIKey is MFYGQFKRCQOBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O.ClH/c1-7-2-8(3-11)6-13(7)10(14)9-4-12-5-9;/h7-9,12H,2-6,11H2,1H3;1H.
What are the key properties of [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride?
[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride has a molecular weight of 233.74 g/mol, XLogP of -0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(aminomethyl)-2-methylpyrrolidin-1-yl]-(azetidin-3-yl)methanone;hydrochloride is sourced from PubChem (CID 130762786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).