N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide

C19H34N4O3 — CID 169227068

IUPACN-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide
SMILESCNCC(=O)N(C(=O)N(C(=O)CNC)C1CCCCC1)C1CCCCC1
InChIInChI=1S/C19H34N4O3/c1-20-13-17(24)22(15-9-5-3-6-10-15)19(26)23(18(25)14-21-2)16-11-7-4-8-12-16/h15-16,20-21H,3-14H2,1-2H3
InChIKeyHVGCYIJALQGQBZ-UHFFFAOYSA-N
MW366.51 g/mol
LogP1.87
Rot. Bonds6

About N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide

N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide (PubChem CID 169227068) has the molecular formula C19H34N4O3 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide
PubChem CID169227068
Molecular FormulaC19H34N4O3
Molecular Weight366.51 g/mol
Exact Mass366.26
IUPAC NameN-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide
SMILESCNCC(=O)N(C(=O)N(C(=O)CNC)C1CCCCC1)C1CCCCC1
InChIInChI=1S/C19H34N4O3/c1-20-13-17(24)22(15-9-5-3-6-10-15)19(26)23(18(25)14-21-2)16-11-7-4-8-12-16/h15-16,20-21H,3-14H2,1-2H3
InChIKeyHVGCYIJALQGQBZ-UHFFFAOYSA-N
XLogP1.87
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl N-cyclohexyl-N-[cyclohexyl(ethoxycarbonyl)carbamoyl]carbamate
CID 152645374
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N-cyclopentyl-2-(methylamino)-N-(2-phenylethyl)acetamide
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CID 119776374
N-cyclopropyl-2-(methylamino)-N-(thian-4-yl)acetamide
CID 121203672
N-cyclohexyl-N-ethyl-2-(ethylamino)acetamide
CID 60686638
2-(tert-butylamino)-N,N-dicyclohexylacetamide
CID 78907368
N-(cyclopropylmethyl)-N-methyl-2-(methylamino)acetamide
CID 60946394
N-cyclopentyl-2-(methylamino)-N-(naphthalen-1-ylmethyl)acetamide;hydrochloride
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CID 56873062

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide?
The IUPAC name of N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide (CID 169227068) is N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide?
The canonical SMILES for N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide is CNCC(=O)N(C(=O)N(C(=O)CNC)C1CCCCC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide?
The InChIKey is HVGCYIJALQGQBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O3/c1-20-13-17(24)22(15-9-5-3-6-10-15)19(26)23(18(25)14-21-2)16-11-7-4-8-12-16/h15-16,20-21H,3-14H2,1-2H3.
What are the key properties of N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide?
N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide has a molecular weight of 366.51 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[cyclohexyl-[2-(methylamino)acetyl]carbamoyl]-2-(methylamino)acetamide is sourced from PubChem (CID 169227068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).