1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine

C9H18N2 — CID 117010148

IUPAC1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine
SMILESCNCC1CN1C1CCCC1
InChIInChI=1S/C9H18N2/c1-10-6-9-7-11(9)8-4-2-3-5-8/h8-10H,2-7H2,1H3
InChIKeyWLGZQKMIJBGQLT-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.83
Rot. Bonds3

About 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine

1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine (PubChem CID 117010148) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine
PubChem CID117010148
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine
SMILESCNCC1CN1C1CCCC1
InChIInChI=1S/C9H18N2/c1-10-6-9-7-11(9)8-4-2-3-5-8/h8-10H,2-7H2,1H3
InChIKeyWLGZQKMIJBGQLT-UHFFFAOYSA-N
XLogP0.83
TPSA15.04 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

1-(4-cyclohexylmorpholin-3-yl)-N-methylmethanamine
CID 83100142
N-methyl-1-(1-methylaziridin-2-yl)methanamine
CID 117010139
1-[1-(3-cyclopropylcyclohexyl)piperidin-2-yl]-N-methylmethanamine
CID 64625242
1-[1-(4-ethylcycloheptyl)pyrrolidin-2-yl]-N-methylmethanamine
CID 115316266
N-methyl-1-[1-(1-propan-2-ylpyrrolidin-3-yl)piperidin-2-yl]methanamine
CID 63249288
N-methyl-1-(1-spiro[4.5]decan-8-ylpyrrolidin-2-yl)methanamine
CID 114818954
1-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-2-yl]-N-methylmethanamine
CID 55169879
1-[(2R)-2-(methylaminomethyl)piperidin-1-yl]ethanone
CID 95037259
1-[1-(2,6-dimethylcyclohexyl)piperidin-2-yl]-N-methylmethanamine
CID 55167772
1-cyclopentyl-5-[(dimethylamino)methyl]pyrrolidin-3-ol
CID 66051873
N-methyl-1-(1-piperidin-3-ylpyrrolidin-2-yl)methanamine;hydrochloride
CID 131086453
(4R)-1-cyclopentyl-4-(methylaminomethyl)pyrrolidin-2-one
CID 26722502

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine (CID 117010148) is 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine is CNCC1CN1C1CCCC1.
What is the InChIKey of 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine?
The InChIKey is WLGZQKMIJBGQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-10-6-9-7-11(9)8-4-2-3-5-8/h8-10H,2-7H2,1H3.
What are the key properties of 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine?
1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine has a molecular weight of 154.26 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylaziridin-2-yl)-N-methylmethanamine is sourced from PubChem (CID 117010148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).