(2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide

C19H22N2O2 — CID 119320933

IUPAC(2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide
SMILESC[C@@H](N)C(=O)NC(c1ccccc1)c1ccc2c(c1)CCCO2
InChIInChI=1S/C19H22N2O2/c1-13(20)19(22)21-18(14-6-3-2-4-7-14)16-9-10-17-15(12-16)8-5-11-23-17/h2-4,6-7,9-10,12-13,18H,5,8,11,20H2,1H3,(H,21,22)/t13-,18?/m1/s1
InChIKeyAQEKPHZNFSWZRA-YJJYDOSJSA-N
MW310.40 g/mol
LogP2.56
Rot. Bonds4

About (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide

(2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide (PubChem CID 119320933) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide
PubChem CID119320933
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name(2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide
SMILESC[C@@H](N)C(=O)NC(c1ccccc1)c1ccc2c(c1)CCCO2
InChIInChI=1S/C19H22N2O2/c1-13(20)19(22)21-18(14-6-3-2-4-7-14)16-9-10-17-15(12-16)8-5-11-23-17/h2-4,6-7,9-10,12-13,18H,5,8,11,20H2,1H3,(H,21,22)/t13-,18?/m1/s1
InChIKeyAQEKPHZNFSWZRA-YJJYDOSJSA-N
XLogP2.56
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]pentanamide
CID 120562483
2-cyano-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]acetamide
CID 91648959
N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]piperidine-4-carboxamide;hydrochloride
CID 119320930
(3S)-N-[(R)-3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]oxolane-3-carboxamide
CID 95319395
N-[(R)-3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]-3-methoxy-1,2-oxazole-5-carboxamide
CID 99701816
6-[(S)-(dimethylsulfamoylamino)-phenylmethyl]-3,4-dihydro-2H-chromene
CID 164630860
N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propan-1-amine
CID 61027484
N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]morpholine-2-carboxamide
CID 119779081
N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 119320936
N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]-3-nitrobenzamide
CID 102556629
methyl 2-(3,4-dihydro-2H-chromen-6-yl)-3-methylbutanoate
CID 116964483
2-amino-2-(3,4-dihydro-2H-chromen-6-yl)-N'-methylacetohydrazide
CID 116849405

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide (CID 119320933) is (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide is C[C@@H](N)C(=O)NC(c1ccccc1)c1ccc2c(c1)CCCO2.
What is the InChIKey of (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide?
The InChIKey is AQEKPHZNFSWZRA-YJJYDOSJSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13(20)19(22)21-18(14-6-3-2-4-7-14)16-9-10-17-15(12-16)8-5-11-23-17/h2-4,6-7,9-10,12-13,18H,5,8,11,20H2,1H3,(H,21,22)/t13-,18?/m1/s1.
What are the key properties of (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide?
(2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide has a molecular weight of 310.40 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[3,4-dihydro-2H-chromen-6-yl(phenyl)methyl]propanamide is sourced from PubChem (CID 119320933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).