6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine

C14H24N4O — CID 115320664

IUPAC6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NCC2CCN(C(C)C)C2)n1
InChIInChI=1S/C14H24N4O/c1-10(2)18-7-6-11(9-18)8-16-14-12(15)4-5-13(17-14)19-3/h4-5,10-11H,6-9,15H2,1-3H3,(H,16,17)
InChIKeyQPWKLIWFJBZGCK-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.81
Rot. Bonds5

About 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine

6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine (PubChem CID 115320664) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine
PubChem CID115320664
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NCC2CCN(C(C)C)C2)n1
InChIInChI=1S/C14H24N4O/c1-10(2)18-7-6-11(9-18)8-16-14-12(15)4-5-13(17-14)19-3/h4-5,10-11H,6-9,15H2,1-3H3,(H,16,17)
InChIKeyQPWKLIWFJBZGCK-UHFFFAOYSA-N
XLogP1.81
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-2-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,3-diamine
CID 113286507
2-methoxy-4-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzene-1,4-diamine
CID 63676271
2-N-[(1,1-dioxothiolan-3-yl)methyl]-6-methoxypyridine-2,3-diamine
CID 113286528
[2-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 113286599
4-hydrazinyl-6-methoxy-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-1,3,5-triazin-2-amine
CID 80908078
2-propan-2-yl-4-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrimidine-4,6-diamine
CID 80957220
methyl 2-[(1-propan-2-ylpyrrolidin-3-yl)methylamino]pyridine-3-carboxylate
CID 62000295
6-methoxy-2-N-(oxan-2-ylmethyl)pyridine-2,3-diamine
CID 113286504
3-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]quinolin-2-amine
CID 63229429
5-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-3,5-diamine
CID 104534038
2-N,5-dimethyl-4-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrimidine-2,4-diamine
CID 80816729
6-chloro-2-N-[(1-methylpiperidin-4-yl)methyl]pyridine-2,3-diamine
CID 113316874

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine?
The IUPAC name of 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine (CID 115320664) is 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine.
What is the SMILES notation for 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine?
The canonical SMILES for 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine is COc1ccc(N)c(NCC2CCN(C(C)C)C2)n1.
What is the InChIKey of 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine?
The InChIKey is QPWKLIWFJBZGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10(2)18-7-6-11(9-18)8-16-14-12(15)4-5-13(17-14)19-3/h4-5,10-11H,6-9,15H2,1-3H3,(H,16,17).
What are the key properties of 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine?
6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine has a molecular weight of 264.37 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2,3-diamine is sourced from PubChem (CID 115320664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).