[1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol

C14H20N2O — CID 113313175

IUPAC[1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol
SMILESOCC1(CNC2CCCc3cccnc32)CC1
InChIInChI=1S/C14H20N2O/c17-10-14(6-7-14)9-16-12-5-1-3-11-4-2-8-15-13(11)12/h2,4,8,12,16-17H,1,3,5-7,9-10H2
InChIKeyOEGNKWYCGKYACW-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.82
Rot. Bonds4

About [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol

[1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol (PubChem CID 113313175) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol
PubChem CID113313175
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name[1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol
SMILESOCC1(CNC2CCCc3cccnc32)CC1
InChIInChI=1S/C14H20N2O/c17-10-14(6-7-14)9-16-12-5-1-3-11-4-2-8-15-13(11)12/h2,4,8,12,16-17H,1,3,5-7,9-10H2
InChIKeyOEGNKWYCGKYACW-UHFFFAOYSA-N
XLogP1.82
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol with MolForge

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Related Compounds

(8S)-N-benzyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 11736560
N-[[4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 71026047
5-(5,6,7,8-tetrahydroquinolin-8-ylamino)pentan-1-ol
CID 107316747
2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol
CID 79078513
N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 114615760
N-prop-2-ynyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079711
N-(cyclopentylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079348
3-methyl-4-(5,6,7,8-tetrahydroquinolin-8-ylamino)butan-1-ol
CID 79080089
3,3-dimethyl-4-(5,6,7,8-tetrahydroquinolin-8-ylamino)butan-1-ol
CID 114149434
N-[[5-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]pyrazin-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 74539206
1-cyclopropyl-2-(5,6,7,8-tetrahydroquinolin-8-ylamino)ethanol
CID 79079971
N-(2-phenylmethoxyethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 141138632

Frequently Asked Questions

What is the IUPAC name of [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol (CID 113313175) is [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol is OCC1(CNC2CCCc3cccnc32)CC1.
What is the InChIKey of [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol?
The InChIKey is OEGNKWYCGKYACW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c17-10-14(6-7-14)9-16-12-5-1-3-11-4-2-8-15-13(11)12/h2,4,8,12,16-17H,1,3,5-7,9-10H2.
What are the key properties of [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol?
[1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol has a molecular weight of 232.33 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]cyclopropyl]methanol is sourced from PubChem (CID 113313175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).