2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine

C13H23N3O2 — CID 113286494

IUPAC2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine
SMILESCCC(C)N(CCOC)c1nc(OC)ccc1N
InChIInChI=1S/C13H23N3O2/c1-5-10(2)16(8-9-17-3)13-11(14)6-7-12(15-13)18-4/h6-7,10H,5,8-9,14H2,1-4H3
InChIKeyQAPPJZMZUBUHFR-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.92
Rot. Bonds7

About 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine

2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine (PubChem CID 113286494) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine
PubChem CID113286494
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine
SMILESCCC(C)N(CCOC)c1nc(OC)ccc1N
InChIInChI=1S/C13H23N3O2/c1-5-10(2)16(8-9-17-3)13-11(14)6-7-12(15-13)18-4/h6-7,10H,5,8-9,14H2,1-4H3
InChIKeyQAPPJZMZUBUHFR-UHFFFAOYSA-N
XLogP1.92
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-2-N-(2-methoxyethyl)-2-N-(1-methoxypropan-2-yl)pyridine-2,3-diamine
CID 115320609
6-methoxy-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)pyridine-2,3-diamine
CID 115320592
6-N-butan-2-yl-3,5-difluoro-6-N-(2-methoxyethyl)pyridine-2,6-diamine
CID 114074357
2-N-(2-ethoxyethyl)-2-N-ethyl-6-methoxypyridine-2,3-diamine
CID 113286561
2-N-[2-(dimethylamino)ethyl]-6-methoxy-2-N-(2-methylpropyl)pyridine-2,3-diamine
CID 115320620
4-N-butan-2-yl-2-chloro-4-N-(2-methoxyethyl)-6-methylpyrimidine-4,5-diamine
CID 114043716
N-butan-2-yl-3,5,6-trichloro-N-(2-methoxyethyl)pyridin-2-amine
CID 102750784
2-N-butan-2-yl-4-N,4-N-diethyl-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4,6-triamine
CID 80787377
6-methoxy-2-N-(4-methoxyphenyl)-2-N-methylpyridine-2,3-diamine
CID 115320673
6-methoxy-2-N-methyl-2-N-(2-methylbutan-2-yl)pyridine-2,3-diamine
CID 115320824
4-N-butan-2-yl-4-N-(2-methoxyethyl)-6-methylpyrimidine-2,4-diamine
CID 80810126
4-N-butan-2-yl-6-ethyl-4-N-(2-methoxyethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103326475

Frequently Asked Questions

What is the IUPAC name of 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine?
The IUPAC name of 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine (CID 113286494) is 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine.
What is the SMILES notation for 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine?
The canonical SMILES for 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine is CCC(C)N(CCOC)c1nc(OC)ccc1N.
What is the InChIKey of 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine?
The InChIKey is QAPPJZMZUBUHFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-5-10(2)16(8-9-17-3)13-11(14)6-7-12(15-13)18-4/h6-7,10H,5,8-9,14H2,1-4H3.
What are the key properties of 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine?
2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine has a molecular weight of 253.35 g/mol, XLogP of 1.92, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,3-diamine is sourced from PubChem (CID 113286494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).