(2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide

C17H17N3O2 — CID 40954214

IUPAC(2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide
SMILESC[C@@H](Nc1ccc2c(c1)Cc1ccccc1-2)C(=O)NC(N)=O
InChIInChI=1S/C17H17N3O2/c1-10(16(21)20-17(18)22)19-13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9-10,19H,8H2,1H3,(H3,18,20,21,22)/t10-/m1/s1
InChIKeyMLNYWEGLMSXKHC-SNVBAGLBSA-N
MW295.34 g/mol
LogP2.25
Rot. Bonds3

About (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide

(2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide (PubChem CID 40954214) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide
PubChem CID40954214
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name(2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide
SMILESC[C@@H](Nc1ccc2c(c1)Cc1ccccc1-2)C(=O)NC(N)=O
InChIInChI=1S/C17H17N3O2/c1-10(16(21)20-17(18)22)19-13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9-10,19H,8H2,1H3,(H3,18,20,21,22)/t10-/m1/s1
InChIKeyMLNYWEGLMSXKHC-SNVBAGLBSA-N
XLogP2.25
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide?
The IUPAC name of (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide (CID 40954214) is (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide.
What is the SMILES notation for (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide?
The canonical SMILES for (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide is C[C@@H](Nc1ccc2c(c1)Cc1ccccc1-2)C(=O)NC(N)=O.
What is the InChIKey of (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide?
The InChIKey is MLNYWEGLMSXKHC-SNVBAGLBSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-10(16(21)20-17(18)22)19-13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9-10,19H,8H2,1H3,(H3,18,20,21,22)/t10-/m1/s1.
What are the key properties of (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide?
(2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide has a molecular weight of 295.34 g/mol, XLogP of 2.25, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-carbamoyl-2-(9H-fluoren-2-ylamino)propanamide is sourced from PubChem (CID 40954214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).