N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide

C19H24N2O2 — CID 120650597

IUPACN-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide
SMILESCCN[C@H](C)CNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C19H24N2O2/c1-3-20-15(2)13-21-19(22)17-10-7-11-18(12-17)23-14-16-8-5-4-6-9-16/h4-12,15,20H,3,13-14H2,1-2H3,(H,21,22)/t15-/m1/s1
InChIKeyMJCLEKTZDNKDFL-OAHLLOKOSA-N
MW312.41 g/mol
LogP2.99
Rot. Bonds8

About N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide

N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide (PubChem CID 120650597) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide
PubChem CID120650597
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide
SMILESCCN[C@H](C)CNC(=O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C19H24N2O2/c1-3-20-15(2)13-21-19(22)17-10-7-11-18(12-17)23-14-16-8-5-4-6-9-16/h4-12,15,20H,3,13-14H2,1-2H3,(H,21,22)/t15-/m1/s1
InChIKeyMJCLEKTZDNKDFL-OAHLLOKOSA-N
XLogP2.99
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide (CID 120650597) is N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide is CCN[C@H](C)CNC(=O)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide?
The InChIKey is MJCLEKTZDNKDFL-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-3-20-15(2)13-21-19(22)17-10-7-11-18(12-17)23-14-16-8-5-4-6-9-16/h4-12,15,20H,3,13-14H2,1-2H3,(H,21,22)/t15-/m1/s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide?
N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide has a molecular weight of 312.41 g/mol, XLogP of 2.99, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide is sourced from PubChem (CID 120650597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).