3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine

C11H13N3O — CID 104804433

IUPAC3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine
SMILESCc1ccoc1C(N)c1cccnc1N
InChIInChI=1S/C11H13N3O/c1-7-4-6-15-10(7)9(12)8-3-2-5-14-11(8)13/h2-6,9H,12H2,1H3,(H2,13,14)
InChIKeyQWOODZUXLAGWGP-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.61
Rot. Bonds2

About 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine

3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine (PubChem CID 104804433) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine
PubChem CID104804433
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine
SMILESCc1ccoc1C(N)c1cccnc1N
InChIInChI=1S/C11H13N3O/c1-7-4-6-15-10(7)9(12)8-3-2-5-14-11(8)13/h2-6,9H,12H2,1H3,(H2,13,14)
InChIKeyQWOODZUXLAGWGP-UHFFFAOYSA-N
XLogP1.61
TPSA78.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol
CID 104800648
3-[amino-(3-methylfuran-2-yl)methyl]pyridin-4-amine
CID 104804566
(2-ethoxyphenyl)-(3-methylfuran-2-yl)methanamine
CID 113455148
(4-bromothiophen-3-yl)-(3-methylfuran-2-yl)methanamine
CID 104804459
(1S,2S)-1-(2-amino-3-pyridinyl)propane-1,2-diamine
CID 131122997
(4-chloronaphthalen-1-yl)-(3-methylfuran-2-yl)methanamine
CID 79596963
3-[(S)-amino(thiophen-3-yl)methyl]pyridin-2-amine
CID 171211334
3-[(1R)-1-amino-4-methylpentyl]pyridin-2-amine
CID 171211340
(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol
CID 130961552
3-[(1S)-1-aminopropyl]pyridin-2-amine;hydrochloride
CID 171230912
3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride
CID 171230932
3-(1-amino-2,2-dimethoxyethyl)pyridin-2-amine
CID 79492532

Frequently Asked Questions

What is the IUPAC name of 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine (CID 104804433) is 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine is Cc1ccoc1C(N)c1cccnc1N.
What is the InChIKey of 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine?
The InChIKey is QWOODZUXLAGWGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-7-4-6-15-10(7)9(12)8-3-2-5-14-11(8)13/h2-6,9H,12H2,1H3,(H2,13,14).
What are the key properties of 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine?
3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine has a molecular weight of 203.25 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[amino-(3-methylfuran-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 104804433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).