1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea

Name: 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₆H₂₁N₃O — CID 155958370

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea

SMILESCC(NC(=O)NCC1CC1)c1ccc2ccn(C)c2c1

InChIInChI=1S/C16H21N3O/c1-11(18-16(20)17-10-12-3-4-12)14-6-5-13-7-8-19(2)15(13)9-14/h5-9,11-12H,3-4,10H2,1-2H3,(H2,17,18,20)

InChIKeyCPNKFUPANICWMG-UHFFFAOYSA-N

MW271.36 g/mol

LogP2.95

Rot. Bonds4

About 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea

1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea (PubChem CID 155958370) has the molecular formula C₁₆H₂₁N₃O and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea.

Molecular Properties

Compound Name	1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea
PubChem CID	155958370
Molecular Formula	C₁₆H₂₁N₃O
Molecular Weight	271.36 g/mol
Exact Mass	271.17
IUPAC Name	1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea
SMILES	CC(NC(=O)NCC1CC1)c1ccc2ccn(C)c2c1
InChI	InChI=1S/C16H21N3O/c1-11(18-16(20)17-10-12-3-4-12)14-6-5-13-7-8-19(2)15(13)9-14/h5-9,11-12H,3-4,10H2,1-2H3,(H2,17,18,20)
InChIKey	CPNKFUPANICWMG-UHFFFAOYSA-N
XLogP	2.95
TPSA	46.06 Å²
H-Bond Donors	2
H-Bond Acceptors	2
Rotatable Bonds	4
Heavy Atoms	20
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	271.36
LogP ≤ 5	2.95
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea?

The IUPAC name of 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea (CID 155958370) is 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea.

What is the SMILES notation for 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea?

The canonical SMILES for 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea is CC(NC(=O)NCC1CC1)c1ccc2ccn(C)c2c1.

What is the InChIKey of 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea?

The InChIKey is CPNKFUPANICWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-11(18-16(20)17-10-12-3-4-12)14-6-5-13-7-8-19(2)15(13)9-14/h5-9,11-12H,3-4,10H2,1-2H3,(H2,17,18,20).

What are the key properties of 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea?

1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea has a molecular weight of 271.36 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(cyclopropylmethyl)-3-[1-(1-methylindol-6-yl)ethyl]urea is sourced from PubChem (CID 155958370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 155958370 — identifiers, structure, computed properties (public domain)

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