N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide

C17H28N2O2 — CID 79116538

IUPACN,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide
SMILESCCCNC1CCC(N(C)C(=O)c2cc(C)oc2C)CC1
InChIInChI=1S/C17H28N2O2/c1-5-10-18-14-6-8-15(9-7-14)19(4)17(20)16-11-12(2)21-13(16)3/h11,14-15,18H,5-10H2,1-4H3
InChIKeyBBRUWRDXMRVGDD-UHFFFAOYSA-N
MW292.42 g/mol
LogP3.28
Rot. Bonds5

About N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide

N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide (PubChem CID 79116538) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide.

Molecular Properties

Compound NameN,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide
PubChem CID79116538
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide
SMILESCCCNC1CCC(N(C)C(=O)c2cc(C)oc2C)CC1
InChIInChI=1S/C17H28N2O2/c1-5-10-18-14-6-8-15(9-7-14)19(4)17(20)16-11-12(2)21-13(16)3/h11,14-15,18H,5-10H2,1-4H3
InChIKeyBBRUWRDXMRVGDD-UHFFFAOYSA-N
XLogP3.28
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(ethylamino)cyclohexyl]-2,5-dimethylfuran-3-carboxamide
CID 43653345
N,3-dimethyl-N-[4-(propylamino)cyclohexyl]furan-2-carboxamide
CID 79122404
N-methyl-N-[4-(propylamino)cyclohexyl]pyridine-4-carboxamide
CID 79122871
N-methyl-N-[4-(propylamino)cyclohexyl]propanamide
CID 79122945
1,1,3-trimethyl-3-[4-(propylamino)cyclohexyl]urea
CID 79153266
N-(1,1-dioxothiolan-3-yl)-N,2,5-trimethylfuran-3-carboxamide
CID 43053942
3-butyl-1-methyl-1-[4-(propylamino)cyclohexyl]urea
CID 79122872
2-[cyclopropyl-(2,5-dimethylfuran-3-carbonyl)amino]acetic acid
CID 54945910
N-methyl-N-[4-(propylamino)cyclohexyl]pyridine-3-carboxamide
CID 79122946
N-methyl-N-[4-(propylamino)cyclohexyl]oxolane-3-carboxamide
CID 79122716
N-methyl-N-[4-(propylamino)cyclohexyl]pentanamide
CID 79122715
N-[4-(ethylamino)cyclohexyl]-N,3,5-trimethylbenzamide
CID 79119344

Frequently Asked Questions

What is the IUPAC name of N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide?
The IUPAC name of N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide (CID 79116538) is N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide.
What is the SMILES notation for N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide?
The canonical SMILES for N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide is CCCNC1CCC(N(C)C(=O)c2cc(C)oc2C)CC1.
What is the InChIKey of N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide?
The InChIKey is BBRUWRDXMRVGDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-5-10-18-14-6-8-15(9-7-14)19(4)17(20)16-11-12(2)21-13(16)3/h11,14-15,18H,5-10H2,1-4H3.
What are the key properties of N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide?
N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide has a molecular weight of 292.42 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,5-trimethyl-N-[4-(propylamino)cyclohexyl]furan-3-carboxamide is sourced from PubChem (CID 79116538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).