(2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide

C16H17N3O2 — CID 124638519

IUPAC(2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide
SMILESC[C@@](N)(Cc1c[nH]c2ccccc12)C(=O)Nc1ccco1
InChIInChI=1S/C16H17N3O2/c1-16(17,15(20)19-14-7-4-8-21-14)9-11-10-18-13-6-3-2-5-12(11)13/h2-8,10,18H,9,17H2,1H3,(H,19,20)/t16-/m1/s1
InChIKeyYSLXCOZYKHQDTC-MRXNPFEDSA-N
MW283.33 g/mol
LogP2.66
Rot. Bonds4

About (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide

(2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide (PubChem CID 124638519) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide
PubChem CID124638519
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name(2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide
SMILESC[C@@](N)(Cc1c[nH]c2ccccc12)C(=O)Nc1ccco1
InChIInChI=1S/C16H17N3O2/c1-16(17,15(20)19-14-7-4-8-21-14)9-11-10-18-13-6-3-2-5-12(11)13/h2-8,10,18H,9,17H2,1H3,(H,19,20)/t16-/m1/s1
InChIKeyYSLXCOZYKHQDTC-MRXNPFEDSA-N
XLogP2.66
TPSA84.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2S)-2-amino-3-(1H-indol-3-yl)-2-(111C)methylpropanoate
CID 14066612
4-[[(2S)-2-amino-3-(1H-indol-3-yl)-2-methylpropanoyl]amino]butanoic acid
CID 67671736
N-(2-adamantyl)-2-amino-3-(1H-indol-3-yl)-2-methylpropanamide
CID 22417241
methyl (2S)-2-amino-2-(deuteriomethyl)-3-(1H-indol-3-yl)propanoate
CID 57296369
prop-2-enyl 2-[[2-amino-3-(1H-indol-3-yl)-2-methylpropanoyl]amino]-4-methylpentanoate
CID 175106415
diethyl 2-(1H-indol-3-ylmethyl)-2-methylpropanedioate
CID 12724509
(2R)-2-amino-N-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-3-(1H-indol-3-yl)-2-methylpropanamide
CID 67892234
[1-[2-(furan-2-yl)ethylamino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamic acid
CID 19047782
N-[1-(1H-indol-3-yl)-2-methylpropan-2-yl]acetamide
CID 113086281
2-amino-N-[2-(1H-indol-3-yl)ethyl]-2-methylbutanamide
CID 79805542
methyl 4-[[(1R)-2-[[(2R)-2-amino-3-(1H-indol-3-yl)-2-methylpropanoyl]amino]-1-phenylethyl]amino]-4-oxobut-2-enoate
CID 54529650
diethyl 2-amino-2-(1H-indol-3-ylmethyl)propanedioate
CID 14315603

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide?
The IUPAC name of (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide (CID 124638519) is (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide?
The canonical SMILES for (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide is C[C@@](N)(Cc1c[nH]c2ccccc12)C(=O)Nc1ccco1.
What is the InChIKey of (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide?
The InChIKey is YSLXCOZYKHQDTC-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-16(17,15(20)19-14-7-4-8-21-14)9-11-10-18-13-6-3-2-5-12(11)13/h2-8,10,18H,9,17H2,1H3,(H,19,20)/t16-/m1/s1.
What are the key properties of (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide?
(2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide has a molecular weight of 283.33 g/mol, XLogP of 2.66, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(furan-2-yl)-3-(1H-indol-3-yl)-2-methylpropanamide is sourced from PubChem (CID 124638519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).