N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine

C11H16N2O2 — CID 107389192

IUPACN-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine
SMILESCC1(C)OCC(CNc2ccccn2)O1
InChIInChI=1S/C11H16N2O2/c1-11(2)14-8-9(15-11)7-13-10-5-3-4-6-12-10/h3-6,9H,7-8H2,1-2H3,(H,12,13)
InChIKeyKTONVQRNQDWTGD-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.64
Rot. Bonds3

About N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine

N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine (PubChem CID 107389192) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine
PubChem CID107389192
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine
SMILESCC1(C)OCC(CNc2ccccn2)O1
InChIInChI=1S/C11H16N2O2/c1-11(2)14-8-9(15-11)7-13-10-5-3-4-6-12-10/h3-6,9H,7-8H2,1-2H3,(H,12,13)
InChIKeyKTONVQRNQDWTGD-UHFFFAOYSA-N
XLogP1.64
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine
CID 106196975
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-1-pyridin-2-ylethanamine
CID 107386677
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-3-ethoxypyridin-2-amine
CID 107389367
2-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]pyridine
CID 10420609
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5-methylpyrimidin-2-amine
CID 104772350
ethyl 6-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]pyridine-3-carboxylate
CID 107389562
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methoxypyrimidin-2-amine
CID 104772335
ethyl 2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]pyridine-3-carboxylate
CID 107389666
2-chloro-N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-methylpyrimidin-4-amine
CID 106196952
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-propoxypyrimidin-4-amine
CID 107389682
N-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]hydroxylamine
CID 23541087
2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methylamino]-6-methylpyridine-4-carbonitrile
CID 107389733

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine?
The IUPAC name of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine (CID 107389192) is N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine is CC1(C)OCC(CNc2ccccn2)O1.
What is the InChIKey of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine?
The InChIKey is KTONVQRNQDWTGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-11(2)14-8-9(15-11)7-13-10-5-3-4-6-12-10/h3-6,9H,7-8H2,1-2H3,(H,12,13).
What are the key properties of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine?
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine has a molecular weight of 208.26 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 107389192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).