N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine

C14H25NO — CID 43205393

IUPACN-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine
SMILESCCCC(C)CNC(C)CCc1ccco1
InChIInChI=1S/C14H25NO/c1-4-6-12(2)11-15-13(3)8-9-14-7-5-10-16-14/h5,7,10,12-13,15H,4,6,8-9,11H2,1-3H3
InChIKeyRKINJHDPKUYDMY-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.63
Rot. Bonds8

About N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine

N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine (PubChem CID 43205393) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine.

Molecular Properties

Compound NameN-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine
PubChem CID43205393
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine
SMILESCCCC(C)CNC(C)CCc1ccco1
InChIInChI=1S/C14H25NO/c1-4-6-12(2)11-15-13(3)8-9-14-7-5-10-16-14/h5,7,10,12-13,15H,4,6,8-9,11H2,1-3H3
InChIKeyRKINJHDPKUYDMY-UHFFFAOYSA-N
XLogP3.63
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methylhexyl)furan
CID 12840321
N-butyl-4-(furan-2-yl)butan-2-amine
CID 43182419
N-but-2-ynyl-4-(furan-2-yl)butan-2-amine
CID 62311547
3-ethyl-N-[4-(furan-2-yl)butan-2-yl]pentan-2-amine
CID 63842275
N-[(1S)-1-(furan-2-yl)ethyl]-2-methylpentan-1-amine
CID 81403881
2-[4-(furan-2-yl)butan-2-ylamino]-1-thiophen-2-ylethanol
CID 54968018
N'-tert-butyl-N-[4-(furan-2-yl)butan-2-yl]ethane-1,2-diamine
CID 107444697
N-ethyl-2-[4-(furan-2-yl)butan-2-ylamino]acetamide
CID 43401748
N-[(4-ethylcyclohexyl)methyl]-4-(furan-2-yl)butan-2-amine
CID 55191977
N-[2-(furan-2-ylmethylsulfanyl)ethyl]pentan-2-amine
CID 62577157
N-[4-(furan-2-yl)butan-2-yl]-4-propylaniline
CID 43478896
ethyl 2-[4-(furan-2-yl)butan-2-ylamino]pentanoate
CID 83042042

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine?
The IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine (CID 43205393) is N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine.
What is the SMILES notation for N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine?
The canonical SMILES for N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine is CCCC(C)CNC(C)CCc1ccco1.
What is the InChIKey of N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine?
The InChIKey is RKINJHDPKUYDMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-6-12(2)11-15-13(3)8-9-14-7-5-10-16-14/h5,7,10,12-13,15H,4,6,8-9,11H2,1-3H3.
What are the key properties of N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine?
N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine has a molecular weight of 223.36 g/mol, XLogP of 3.63, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)butan-2-yl]-2-methylpentan-1-amine is sourced from PubChem (CID 43205393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).