3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine

C12H26N2O2 — CID 79469576

IUPAC3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine
SMILESCOCCN(C(C)COC)C1CCC(N)C1
InChIInChI=1S/C12H26N2O2/c1-10(9-16-3)14(6-7-15-2)12-5-4-11(13)8-12/h10-12H,4-9,13H2,1-3H3
InChIKeyOWOMQHOYATVVDP-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.85
Rot. Bonds7

About 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine

3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine (PubChem CID 79469576) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine.

Molecular Properties

Compound Name3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine
PubChem CID79469576
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine
SMILESCOCCN(C(C)COC)C1CCC(N)C1
InChIInChI=1S/C12H26N2O2/c1-10(9-16-3)14(6-7-15-2)12-5-4-11(13)8-12/h10-12H,4-9,13H2,1-3H3
InChIKeyOWOMQHOYATVVDP-UHFFFAOYSA-N
XLogP0.85
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-N-ethyl-1-N-(1-methoxypropan-2-yl)cyclobutane-1,3-diamine
CID 80561797
4-N-cyclopropyl-4-N-(2-methoxyethyl)pentane-2,4-diamine
CID 64706170
3-[cyclopropyl(2-methoxyethyl)amino]butanethioamide
CID 61451186
4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol
CID 64720380
4-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclohexane-1-carboxamide
CID 62781952
4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)cyclohexane-1,4-diamine
CID 62806205
2-N-cyclopropyl-2-N-(2-methoxyethyl)-1-N-(3-methoxypropyl)propane-1,2-diamine
CID 62569230
2-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclopentan-1-amine
CID 55000765
3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)-1,1-dioxothiolane-3,4-diamine
CID 55108817
N-(3-bromopropyl)-N-(1-methoxypropan-2-yl)cyclobutanamine
CID 102860106
4-[cyclopropyl(2-methoxyethyl)amino]-2-methyl-2-(propylamino)pentanamide
CID 64711835
1-(ethylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]cyclopentane-1-carboxamide
CID 79647416

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine?
The IUPAC name of 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine (CID 79469576) is 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine.
What is the SMILES notation for 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine?
The canonical SMILES for 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine is COCCN(C(C)COC)C1CCC(N)C1.
What is the InChIKey of 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine?
The InChIKey is OWOMQHOYATVVDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-10(9-16-3)14(6-7-15-2)12-5-4-11(13)8-12/h10-12H,4-9,13H2,1-3H3.
What are the key properties of 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine?
3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine has a molecular weight of 230.35 g/mol, XLogP of 0.85, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-methoxyethyl)-3-N-(1-methoxypropan-2-yl)cyclopentane-1,3-diamine is sourced from PubChem (CID 79469576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).