2-(methoxymethyl)-N-phenylpyrrolidin-1-amine

C12H18N2O — CID 91183641

IUPAC2-(methoxymethyl)-N-phenylpyrrolidin-1-amine
SMILESCOCC1CCCN1Nc1ccccc1
InChIInChI=1S/C12H18N2O/c1-15-10-12-8-5-9-14(12)13-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3
InChIKeyAPGHHHMIWWFXRN-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.12
Rot. Bonds4

About 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine

2-(methoxymethyl)-N-phenylpyrrolidin-1-amine (PubChem CID 91183641) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N-phenylpyrrolidin-1-amine
PubChem CID91183641
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-(methoxymethyl)-N-phenylpyrrolidin-1-amine
SMILESCOCC1CCCN1Nc1ccccc1
InChIInChI=1S/C12H18N2O/c1-15-10-12-8-5-9-14(12)13-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3
InChIKeyAPGHHHMIWWFXRN-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]-3-phenylthiourea
CID 135042441
(2S)-2-(methoxymethyl)-N-[(2R)-4-phenylbutan-2-yl]pyrrolidin-1-amine
CID 135000070
(2S)-2-(methoxymethyl)-N-[(3R)-4-methyl-1-phenylpentan-3-yl]pyrrolidin-1-amine
CID 135001015
(2R)-N-(cyclohexen-1-yl)-2-(methoxymethyl)pyrrolidin-1-amine
CID 90912074
(2S)-N-[(1R)-1,3-diphenylpropyl]-2-(methoxymethyl)pyrrolidin-1-amine
CID 134924028
2-chloro-N-phenylpyrrolidin-1-amine
CID 123425797
CID 10925908
CID 10925908
CID 58903834
CID 58903834
6-hydrazinylidene-N-[2-(methoxymethyl)pyrrolidin-1-yl]-2,3-dihydropyridin-1-amine
CID 123292210
(2S)-N-[(2S,3R)-2-benzylsulfanyl-1-phenylheptan-3-yl]-2-(methoxymethyl)pyrrolidin-1-amine
CID 11235668
(2S)-N-[(3S,4R)-3-benzylsulfanyl-2-methyloctan-4-yl]-2-(methoxymethyl)pyrrolidin-1-amine
CID 11153167
2-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]benzoic acid
CID 129496688

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine?
The IUPAC name of 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine (CID 91183641) is 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine?
The canonical SMILES for 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine is COCC1CCCN1Nc1ccccc1.
What is the InChIKey of 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine?
The InChIKey is APGHHHMIWWFXRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-15-10-12-8-5-9-14(12)13-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3.
What are the key properties of 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine?
2-(methoxymethyl)-N-phenylpyrrolidin-1-amine has a molecular weight of 206.29 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-phenylpyrrolidin-1-amine is sourced from PubChem (CID 91183641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).