(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine

C11H15N3O — CID 82867029

IUPAC(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
SMILESC[C@@H](NCc1ccn(C)n1)c1ccco1
InChIInChI=1S/C11H15N3O/c1-9(11-4-3-7-15-11)12-8-10-5-6-14(2)13-10/h3-7,9,12H,8H2,1-2H3/t9-/m1/s1
InChIKeyQZHVNGOPKBMUID-SECBINFHSA-N
MW205.26 g/mol
LogP1.86
Rot. Bonds4

About (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine

(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine (PubChem CID 82867029) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
PubChem CID82867029
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
SMILESC[C@@H](NCc1ccn(C)n1)c1ccco1
InChIInChI=1S/C11H15N3O/c1-9(11-4-3-7-15-11)12-8-10-5-6-14(2)13-10/h3-7,9,12H,8H2,1-2H3/t9-/m1/s1
InChIKeyQZHVNGOPKBMUID-SECBINFHSA-N
XLogP1.86
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-yl)-N-[2-(1-methylpyrazol-3-yl)ethyl]ethanamine
CID 104629058
(1R)-1-(furan-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamine
CID 81403604
(1S)-1-(furan-2-yl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamine
CID 81403202
3-methyl-N-[(1-methylpyrazol-3-yl)methyl]butan-2-amine
CID 78920945
(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-4-yl)methyl]ethanamine
CID 81402958
1-(furan-2-yl)-N-[(3-methyltriazol-4-yl)methyl]ethanamine
CID 115682172
(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 81401203
(1R)-1-(3-bromophenyl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
CID 82865696
N-[(1-methylpyrazol-3-yl)methyl]-1-naphthalen-2-ylethanamine
CID 78921020
3-[(1-methylpyrazol-3-yl)methylamino]butan-2-ol
CID 82882501
1-bromo-N-[(1-methylpyrazol-3-yl)methyl]propan-2-amine
CID 107859736
(1S)-1-(4-methoxyphenyl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
CID 82867137

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine?
The IUPAC name of (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine (CID 82867029) is (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine.
What is the SMILES notation for (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine?
The canonical SMILES for (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine is C[C@@H](NCc1ccn(C)n1)c1ccco1.
What is the InChIKey of (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine?
The InChIKey is QZHVNGOPKBMUID-SECBINFHSA-N. The full InChI is InChI=1S/C11H15N3O/c1-9(11-4-3-7-15-11)12-8-10-5-6-14(2)13-10/h3-7,9,12H,8H2,1-2H3/t9-/m1/s1.
What are the key properties of (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine?
(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine has a molecular weight of 205.26 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine is sourced from PubChem (CID 82867029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).