N-[(R)-(3-methylphenyl)-phenylmethyl]formamide

C15H15NO — CID 12969500

IUPACN-[(R)-(3-methylphenyl)-phenylmethyl]formamide
SMILESCc1cccc([C@H](NC=O)c2ccccc2)c1
InChIInChI=1S/C15H15NO/c1-12-6-5-9-14(10-12)15(16-11-17)13-7-3-2-4-8-13/h2-11,15H,1H3,(H,16,17)/t15-/m1/s1
InChIKeyPBZFJQHAVUQJBK-OAHLLOKOSA-N
MW225.29 g/mol
LogP2.83
Rot. Bonds4

About N-[(R)-(3-methylphenyl)-phenylmethyl]formamide

N-[(R)-(3-methylphenyl)-phenylmethyl]formamide (PubChem CID 12969500) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is N-[(R)-(3-methylphenyl)-phenylmethyl]formamide.

Molecular Properties

Compound NameN-[(R)-(3-methylphenyl)-phenylmethyl]formamide
PubChem CID12969500
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC NameN-[(R)-(3-methylphenyl)-phenylmethyl]formamide
SMILESCc1cccc([C@H](NC=O)c2ccccc2)c1
InChIInChI=1S/C15H15NO/c1-12-6-5-9-14(10-12)15(16-11-17)13-7-3-2-4-8-13/h2-11,15H,1H3,(H,16,17)/t15-/m1/s1
InChIKeyPBZFJQHAVUQJBK-OAHLLOKOSA-N
XLogP2.83
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[(R)-(4-methylphenyl)-phenylmethyl]formamide
CID 2119878
N-[(3-hydroxyphenyl)-phenylmethyl]formamide
CID 86676910
N-[(3-methylphenyl)-phenylmethyl]hydroxylamine
CID 142769620
N-[(S)-(3-nitrophenyl)-phenylmethyl]formamide
CID 867448
N-[(S)-(4-fluorophenyl)-phenylmethyl]formamide
CID 11499592
2-[[(3-methylphenyl)-phenylmethyl]amino]ethanol
CID 144916597
2-[[(3-methylphenyl)-phenylmethyl]amino]propan-1-ol
CID 144917101
(2R)-2-(3-methylphenyl)propanal
CID 15372593
(2S)-2-(3-methylphenyl)propanal
CID 124547254
N-[(3-methylphenyl)-phenylmethyl]cyclohexanamine
CID 146752027
1-[(S)-(3-methylphenyl)-phenylmethyl]-3-phenylthiourea
CID 100726368
(1R)-N-[1-(3-methylphenyl)ethyl]-1-phenylethanamine
CID 79040987

Frequently Asked Questions

What is the IUPAC name of N-[(R)-(3-methylphenyl)-phenylmethyl]formamide?
The IUPAC name of N-[(R)-(3-methylphenyl)-phenylmethyl]formamide (CID 12969500) is N-[(R)-(3-methylphenyl)-phenylmethyl]formamide.
What is the SMILES notation for N-[(R)-(3-methylphenyl)-phenylmethyl]formamide?
The canonical SMILES for N-[(R)-(3-methylphenyl)-phenylmethyl]formamide is Cc1cccc([C@H](NC=O)c2ccccc2)c1.
What is the InChIKey of N-[(R)-(3-methylphenyl)-phenylmethyl]formamide?
The InChIKey is PBZFJQHAVUQJBK-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H15NO/c1-12-6-5-9-14(10-12)15(16-11-17)13-7-3-2-4-8-13/h2-11,15H,1H3,(H,16,17)/t15-/m1/s1.
What are the key properties of N-[(R)-(3-methylphenyl)-phenylmethyl]formamide?
N-[(R)-(3-methylphenyl)-phenylmethyl]formamide has a molecular weight of 225.29 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-(3-methylphenyl)-phenylmethyl]formamide is sourced from PubChem (CID 12969500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).