1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide

C11H21N3O — CID 115182657

IUPAC1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide
SMILESCN1CCC(N(C)C(=O)C2(CN)CC2)C1
InChIInChI=1S/C11H21N3O/c1-13-6-3-9(7-13)14(2)10(15)11(8-12)4-5-11/h9H,3-8,12H2,1-2H3
InChIKeyMDJIYYLHWQIQOZ-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.11
Rot. Bonds3

About 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide

1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide (PubChem CID 115182657) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide
PubChem CID115182657
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide
SMILESCN1CCC(N(C)C(=O)C2(CN)CC2)C1
InChIInChI=1S/C11H21N3O/c1-13-6-3-9(7-13)14(2)10(15)11(8-12)4-5-11/h9H,3-8,12H2,1-2H3
InChIKeyMDJIYYLHWQIQOZ-UHFFFAOYSA-N
XLogP-0.11
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-methyl-N-(thiolan-3-yl)cyclopropane-1-carboxamide
CID 115452254
2-amino-N-methyl-N-[(3S)-1-methylpyrrolidin-3-yl]acetamide
CID 66565800
1-cyano-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclobutane-1-carboxamide
CID 115183296
4-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclohexane-1-carboxamide
CID 115151057
1-(aminomethyl)-N-(4-ethylcyclohexyl)-N-methylcyclobutane-1-carboxamide
CID 80588442
1-(aminomethyl)-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexane-1-carboxamide
CID 63236819
3-amino-N,2,2-trimethyl-N-(1-methylpyrrolidin-3-yl)propanamide
CID 115154624
4-(aminomethyl)-N-(1,2-dimethylpiperidin-4-yl)-N-methyloxane-4-carboxamide;dihydrochloride
CID 120942328
3-ethyl-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-3-carboxamide
CID 63133087
2-amino-N-methyl-N-[(3S)-1-methylpiperidin-3-yl]acetamide
CID 66565804
1-cyano-N-methyl-N-(1-methylpiperidin-3-yl)cyclobutane-1-carboxamide
CID 79005497
4-amino-N,3,3-trimethyl-N-(1-methylpyrrolidin-3-yl)butanamide
CID 115157304

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide (CID 115182657) is 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide is CN1CCC(N(C)C(=O)C2(CN)CC2)C1.
What is the InChIKey of 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide?
The InChIKey is MDJIYYLHWQIQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-13-6-3-9(7-13)14(2)10(15)11(8-12)4-5-11/h9H,3-8,12H2,1-2H3.
What are the key properties of 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide?
1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide has a molecular weight of 211.31 g/mol, XLogP of -0.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 115182657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).