N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide

C14H25N3O2 — CID 62639953

IUPACN-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide
SMILESCC(NCCN(C)C(C)C)C(=O)NCc1ccco1
InChIInChI=1S/C14H25N3O2/c1-11(2)17(4)8-7-15-12(3)14(18)16-10-13-6-5-9-19-13/h5-6,9,11-12,15H,7-8,10H2,1-4H3,(H,16,18)
InChIKeyCKPLOPPBINUJCZ-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.21
Rot. Bonds8

About N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide

N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide (PubChem CID 62639953) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide
PubChem CID62639953
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide
SMILESCC(NCCN(C)C(C)C)C(=O)NCc1ccco1
InChIInChI=1S/C14H25N3O2/c1-11(2)17(4)8-7-15-12(3)14(18)16-10-13-6-5-9-19-13/h5-6,9,11-12,15H,7-8,10H2,1-4H3,(H,16,18)
InChIKeyCKPLOPPBINUJCZ-UHFFFAOYSA-N
XLogP1.21
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[ethyl(methyl)amino]ethylamino]-N-(furan-2-ylmethyl)propanamide
CID 62641023
(2R)-2-[3-(dimethylamino)propylamino]-N-(furan-2-ylmethyl)propanamide
CID 7437364
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964
2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 43466208
2-[[2-(dimethylamino)-2-methylpropyl]amino]-N-(furan-2-ylmethyl)propanamide
CID 54940460
N-(furan-2-ylmethyl)-2-(3-propoxypropylamino)propanamide
CID 82943073
2-(furan-2-ylmethylamino)-N-(2-methoxyethyl)propanamide
CID 43086708
N-(furan-2-ylmethyl)-2-(methoxyamino)propanamide
CID 60702583
2-[[1-(dimethylamino)cyclopentyl]methylamino]-N-(furan-2-ylmethyl)propanamide
CID 78915193
N-[2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]ethyl]cyclopropanecarboxamide
CID 115574214
2-[2-aminoethyl(methyl)amino]-N-(furan-2-ylmethyl)propanamide
CID 61348725
N-(furan-2-ylmethyl)-2-[[2-oxo-2-(propylamino)ethyl]amino]propanamide
CID 43401459

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide (CID 62639953) is N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide is CC(NCCN(C)C(C)C)C(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide?
The InChIKey is CKPLOPPBINUJCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-11(2)17(4)8-7-15-12(3)14(18)16-10-13-6-5-9-19-13/h5-6,9,11-12,15H,7-8,10H2,1-4H3,(H,16,18).
What are the key properties of N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide?
N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide has a molecular weight of 267.37 g/mol, XLogP of 1.21, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[2-[methyl(propan-2-yl)amino]ethylamino]propanamide is sourced from PubChem (CID 62639953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).