N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine

C12H22N2O — CID 178157129

IUPACN-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine
SMILESCC(C)N1CCC(N[C@@H]2C=COC2)CC1
InChIInChI=1S/C12H22N2O/c1-10(2)14-6-3-11(4-7-14)13-12-5-8-15-9-12/h5,8,10-13H,3-4,6-7,9H2,1-2H3/t12-/m1/s1
InChIKeyDOCPQRWIDNGILB-GFCCVEGCSA-N
MW210.32 g/mol
LogP1.36
Rot. Bonds3

About N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine

N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine (PubChem CID 178157129) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine
PubChem CID178157129
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine
SMILESCC(C)N1CCC(N[C@@H]2C=COC2)CC1
InChIInChI=1S/C12H22N2O/c1-10(2)14-6-3-11(4-7-14)13-12-5-8-15-9-12/h5,8,10-13H,3-4,6-7,9H2,1-2H3/t12-/m1/s1
InChIKeyDOCPQRWIDNGILB-GFCCVEGCSA-N
XLogP1.36
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydrofuran-2-ylmethyl)-N'-(1-methylpiperidin-4-yl)methanediamine
CID 143176493
N-(3-morpholin-4-ylpropyl)hept-1-en-4-amine
CID 4712416
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-1-propylpiperidin-4-amine
CID 55030783
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-1-ethylpiperidin-4-amine
CID 62064425
1-butyl-N-(3,4-dihydro-2H-pyran-2-ylmethyl)piperidin-4-amine
CID 62064573
3-N-(3,4-dihydro-2H-pyran-2-ylmethyl)-1-N,1-N-dimethylbutane-1,3-diamine
CID 62065469
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-1-propan-2-ylpiperidin-4-amine
CID 62065611
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-1-methylpiperidin-4-amine
CID 62065967
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-3-(2-methylpiperidin-1-yl)propan-1-amine
CID 62066697
N-[(1-but-3-en-2-ylpiperidin-4-yl)methyl]-2-methoxyethanamine
CID 63848444
N-[(1-but-3-en-2-ylpiperidin-3-yl)methyl]-2-methoxyethanamine
CID 63849538
N-[(1-but-3-en-2-ylpiperidin-2-yl)methyl]-2-methoxyethanamine
CID 63854960

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine (CID 178157129) is N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine is CC(C)N1CCC(N[C@@H]2C=COC2)CC1.
What is the InChIKey of N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine?
The InChIKey is DOCPQRWIDNGILB-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H22N2O/c1-10(2)14-6-3-11(4-7-14)13-12-5-8-15-9-12/h5,8,10-13H,3-4,6-7,9H2,1-2H3/t12-/m1/s1.
What are the key properties of N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine?
N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine has a molecular weight of 210.32 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-2,3-dihydrofuran-3-yl]-1-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 178157129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).