N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine

C16H24N2O — CID 103069652

IUPACN-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine
SMILESC=C(CNC1CC1)CN(C)Cc1ccccc1OC
InChIInChI=1S/C16H24N2O/c1-13(10-17-15-8-9-15)11-18(2)12-14-6-4-5-7-16(14)19-3/h4-7,15,17H,1,8-12H2,2-3H3
InChIKeyHFDOAUJBUVXHJM-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.44
Rot. Bonds8

About N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine

N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine (PubChem CID 103069652) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine
PubChem CID103069652
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine
SMILESC=C(CNC1CC1)CN(C)Cc1ccccc1OC
InChIInChI=1S/C16H24N2O/c1-13(10-17-15-8-9-15)11-18(2)12-14-6-4-5-7-16(14)19-3/h4-7,15,17H,1,8-12H2,2-3H3
InChIKeyHFDOAUJBUVXHJM-UHFFFAOYSA-N
XLogP2.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(2-ethylphenoxy)methyl]prop-2-enyl]cyclopropanamine
CID 103066925
[2-[2-[(cyclopropylamino)methyl]prop-2-enoxy]phenyl]methanol
CID 103067254
2-(cyclopropylamino)-N-[(2-ethoxyphenyl)methyl]-N-methylacetamide
CID 54873700
3-[(2-methoxyphenyl)methyl-methylamino]propanamide
CID 27095531
N-ethyl-N'-(2-methoxyphenyl)-N'-methyl-2-methylidenepropane-1,3-diamine
CID 103070217
N-[(2-methoxyphenyl)methyl]-N-methyl-1-piperidin-4-ylmethanamine
CID 61417528
N'-[(2-methoxyphenyl)methyl]-N'-methyl-N-prop-2-enylethane-1,2-diamine
CID 62554444
N-[1-(2-methoxyphenyl)propan-2-yl]-N,N'-dimethyl-2-methylidenepropane-1,3-diamine
CID 103070828
N-[2-[(2-propoxyphenoxy)methyl]prop-2-enyl]cyclopropanamine
CID 103066359
4-[(2-methoxyphenyl)methyl-methylamino]-3-oxobutanenitrile
CID 117038516
2-bromo-N-[(2-methoxyphenyl)methyl]-N-methylethanamine
CID 61417709
N-[[2-[(cyclopropylamino)methyl]furan-3-yl]methyl]-2-methoxy-N-methylaniline
CID 62428787

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine (CID 103069652) is N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine is C=C(CNC1CC1)CN(C)Cc1ccccc1OC.
What is the InChIKey of N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine?
The InChIKey is HFDOAUJBUVXHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13(10-17-15-8-9-15)11-18(2)12-14-6-4-5-7-16(14)19-3/h4-7,15,17H,1,8-12H2,2-3H3.
What are the key properties of N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine?
N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine has a molecular weight of 260.38 g/mol, XLogP of 2.44, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-[(2-methoxyphenyl)methyl]-N'-methyl-2-methylidenepropane-1,3-diamine is sourced from PubChem (CID 103069652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).