2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride

C11H25Cl2N3O — CID 119866874

IUPAC2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride
SMILESCN1CCC(CNC(=O)C(C)(C)N)CC1.Cl.Cl
InChIInChI=1S/C11H23N3O.2ClH/c1-11(2,12)10(15)13-8-9-4-6-14(3)7-5-9;;/h9H,4-8,12H2,1-3H3,(H,13,15);2*1H
InChIKeyJIKVAYIRTDPYLW-UHFFFAOYSA-N
MW286.25 g/mol
LogP1.03
Rot. Bonds3

About 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride

2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride (PubChem CID 119866874) has the molecular formula C11H25Cl2N3O and a molecular weight of 286.25 g/mol. Its IUPAC name is 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride
PubChem CID119866874
Molecular FormulaC11H25Cl2N3O
Molecular Weight286.25 g/mol
Exact Mass285.14
IUPAC Name2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride
SMILESCN1CCC(CNC(=O)C(C)(C)N)CC1.Cl.Cl
InChIInChI=1S/C11H23N3O.2ClH/c1-11(2,12)10(15)13-8-9-4-6-14(3)7-5-9;;/h9H,4-8,12H2,1-3H3,(H,13,15);2*1H
InChIKeyJIKVAYIRTDPYLW-UHFFFAOYSA-N
XLogP1.03
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.25
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
CID 61264835
4-amino-2,2-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]butanamide
CID 115157046
2-amino-N-(cyclopentylmethyl)-2-methylpropanamide
CID 61266758
2-amino-N-[(4-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 106135736
2-amino-2-cyclopropyl-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
CID 60856927
1-amino-N-[(1-methylpiperidin-4-yl)methyl]cyclopropane-1-carboxamide
CID 65465788
2-amino-2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pentanamide
CID 60856275
4-amino-2,2-dimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]butanamide
CID 115157048
2-(cyclopropylmethylamino)-N-[(1-methylpiperidin-4-yl)methyl]acetamide;dihydrochloride
CID 119866901
N-[(1-methylpiperidin-4-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605397
2-amino-2-methyl-N-[(3-methylcyclopentyl)methyl]propanamide
CID 107413148
1-amino-N-[(1-methylpiperidin-4-yl)methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119866892

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride?
The IUPAC name of 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride (CID 119866874) is 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride is CN1CCC(CNC(=O)C(C)(C)N)CC1.Cl.Cl.
What is the InChIKey of 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride?
The InChIKey is JIKVAYIRTDPYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O.2ClH/c1-11(2,12)10(15)13-8-9-4-6-14(3)7-5-9;;/h9H,4-8,12H2,1-3H3,(H,13,15);2*1H.
What are the key properties of 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride?
2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride has a molecular weight of 286.25 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide;dihydrochloride is sourced from PubChem (CID 119866874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).