1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea

C26H26N2O — CID 101424575

IUPAC1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea
SMILESC[C@H](NC(=O)N(C)[C@H](C)c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C26H26N2O/c1-18(22-16-8-12-20-10-4-6-14-24(20)22)27-26(29)28(3)19(2)23-17-9-13-21-11-5-7-15-25(21)23/h4-19H,1-3H3,(H,27,29)/t18-,19+/m0/s1
InChIKeySNVXMPNPLOMQNG-RBUKOAKNSA-N
MW382.51 g/mol
LogP6.46
Rot. Bonds4

About 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea

1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea (PubChem CID 101424575) has the molecular formula C26H26N2O and a molecular weight of 382.51 g/mol. Its IUPAC name is 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea.

Molecular Properties

Compound Name1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea
PubChem CID101424575
Molecular FormulaC26H26N2O
Molecular Weight382.51 g/mol
Exact Mass382.20
IUPAC Name1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea
SMILESC[C@H](NC(=O)N(C)[C@H](C)c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C26H26N2O/c1-18(22-16-8-12-20-10-4-6-14-24(20)22)27-26(29)28(3)19(2)23-17-9-13-21-11-5-7-15-25(21)23/h4-19H,1-3H3,(H,27,29)/t18-,19+/m0/s1
InChIKeySNVXMPNPLOMQNG-RBUKOAKNSA-N
XLogP6.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.51
LogP ≤ 56.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(1-naphthalen-1-ylethyl)-N-[(1S)-1-naphthalen-1-ylethyl]oxamide
CID 90809930
N-(1-naphthalen-1-ylethyl)propanamide
CID 13202765
N-(1-naphthalen-1-ylethyl)naphthalene-1-carboxamide
CID 593320
3-[[(1R)-1-naphthalen-1-ylethyl]amino]but-2-enoic acid
CID 70562047
3-[[(1S)-1-naphthalen-1-ylethyl]amino]but-2-enoic acid
CID 70562068
2,2,2-trichloro-N-(1-naphthalen-1-ylethyl)acetamide
CID 14511505
2-[carboxymethyl-[(1S)-1-naphthalen-1-ylethyl]amino]acetic acid
CID 118026822
2-bromo-3-methyl-N-(1-naphthalen-1-ylethyl)butanamide
CID 43346795
tert-butyl N-[(1R)-1-naphthalen-1-ylethyl]carbamate
CID 25171739
2-[[(1R)-1-naphthalen-1-ylethyl]carbamoyl]benzoic acid
CID 853685
phenyl N-[(1R)-1-naphthalen-1-ylethyl]carbamate
CID 102094307
1-methyl-3-(1-naphthalen-1-ylethyl)-1-(oxan-2-ylmethyl)urea
CID 86826830

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea?
The IUPAC name of 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea (CID 101424575) is 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea.
What is the SMILES notation for 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea?
The canonical SMILES for 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea is C[C@H](NC(=O)N(C)[C@H](C)c1cccc2ccccc12)c1cccc2ccccc12.
What is the InChIKey of 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea?
The InChIKey is SNVXMPNPLOMQNG-RBUKOAKNSA-N. The full InChI is InChI=1S/C26H26N2O/c1-18(22-16-8-12-20-10-4-6-14-24(20)22)27-26(29)28(3)19(2)23-17-9-13-21-11-5-7-15-25(21)23/h4-19H,1-3H3,(H,27,29)/t18-,19+/m0/s1.
What are the key properties of 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea?
1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea has a molecular weight of 382.51 g/mol, XLogP of 6.46, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-[(1R)-1-naphthalen-1-ylethyl]-3-[(1S)-1-naphthalen-1-ylethyl]urea is sourced from PubChem (CID 101424575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).