(3R)-1-(furan-2-yl)-4-methylpentan-3-amine

C10H17NO — CID 94915074

IUPAC(3R)-1-(furan-2-yl)-4-methylpentan-3-amine
SMILESCC(C)[C@H](N)CCc1ccco1
InChIInChI=1S/C10H17NO/c1-8(2)10(11)6-5-9-4-3-7-12-9/h3-4,7-8,10H,5-6,11H2,1-2H3/t10-/m1/s1
InChIKeyOQSSPKJTUARHTK-SNVBAGLBSA-N
MW167.25 g/mol
LogP2.20
Rot. Bonds4

About (3R)-1-(furan-2-yl)-4-methylpentan-3-amine

(3R)-1-(furan-2-yl)-4-methylpentan-3-amine (PubChem CID 94915074) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is (3R)-1-(furan-2-yl)-4-methylpentan-3-amine.

Molecular Properties

Compound Name(3R)-1-(furan-2-yl)-4-methylpentan-3-amine
PubChem CID94915074
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name(3R)-1-(furan-2-yl)-4-methylpentan-3-amine
SMILESCC(C)[C@H](N)CCc1ccco1
InChIInChI=1S/C10H17NO/c1-8(2)10(11)6-5-9-4-3-7-12-9/h3-4,7-8,10H,5-6,11H2,1-2H3/t10-/m1/s1
InChIKeyOQSSPKJTUARHTK-SNVBAGLBSA-N
XLogP2.20
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-amino-6-(furan-2-yl)-2-methylhexan-3-yl]cyclopropane-1-thiol
CID 146386178
1,4-bis(furan-2-yl)butan-2-amine
CID 105177346
2-(3-methylhexyl)furan
CID 12840321
1-(furan-2-yl)-6-methylheptan-3-ol
CID 105085501
(2S)-2-amino-N-[2-(furan-2-yl)ethyl]propanamide
CID 61147120
2-[4-(furan-2-yl)butan-2-ylamino]-N'-hydroxypropanimidamide
CID 77030711
N-[4-(furan-2-yl)butan-2-yl]-2-methyl-1-phenylpropan-1-amine
CID 43685449
4-(furan-2-yl)-1-(4-methylphenyl)butan-2-amine
CID 61077814
6,6,6-trifluoro-1-(furan-2-yl)hexan-3-amine
CID 105156341
3-(furan-2-yl)-1-(2-propan-2-yloxyphenyl)propan-1-amine
CID 105170945
(1S)-1-(3,4-dimethylphenyl)-3-(furan-2-yl)propan-1-amine
CID 40511217
1-amino-2-[4-(furan-2-yl)butan-2-yl]guanidine
CID 64872844

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(furan-2-yl)-4-methylpentan-3-amine?
The IUPAC name of (3R)-1-(furan-2-yl)-4-methylpentan-3-amine (CID 94915074) is (3R)-1-(furan-2-yl)-4-methylpentan-3-amine.
What is the SMILES notation for (3R)-1-(furan-2-yl)-4-methylpentan-3-amine?
The canonical SMILES for (3R)-1-(furan-2-yl)-4-methylpentan-3-amine is CC(C)[C@H](N)CCc1ccco1.
What is the InChIKey of (3R)-1-(furan-2-yl)-4-methylpentan-3-amine?
The InChIKey is OQSSPKJTUARHTK-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H17NO/c1-8(2)10(11)6-5-9-4-3-7-12-9/h3-4,7-8,10H,5-6,11H2,1-2H3/t10-/m1/s1.
What are the key properties of (3R)-1-(furan-2-yl)-4-methylpentan-3-amine?
(3R)-1-(furan-2-yl)-4-methylpentan-3-amine has a molecular weight of 167.25 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(furan-2-yl)-4-methylpentan-3-amine is sourced from PubChem (CID 94915074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).