N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine

C16H20N4O — CID 97178411

IUPACN-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine
SMILESc1ccc2nc(OC[C@@H]3CCNC3)c(NC3CC3)nc2c1
InChIInChI=1S/C16H20N4O/c1-2-4-14-13(3-1)19-15(18-12-5-6-12)16(20-14)21-10-11-7-8-17-9-11/h1-4,11-12,17H,5-10H2,(H,18,19)/t11-/m1/s1
InChIKeyBBOVWSNXRWHVPP-LLVKDONJSA-N
MW284.36 g/mol
LogP2.19
Rot. Bonds5

About N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine

N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine (PubChem CID 97178411) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine
PubChem CID97178411
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine
SMILESc1ccc2nc(OC[C@@H]3CCNC3)c(NC3CC3)nc2c1
InChIInChI=1S/C16H20N4O/c1-2-4-14-13(3-1)19-15(18-12-5-6-12)16(20-14)21-10-11-7-8-17-9-11/h1-4,11-12,17H,5-10H2,(H,18,19)/t11-/m1/s1
InChIKeyBBOVWSNXRWHVPP-LLVKDONJSA-N
XLogP2.19
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-3-(pyrrolidin-3-ylmethoxy)quinoxalin-2-amine
CID 71636942
2-methoxy-3-(pyrrolidin-3-ylmethoxy)quinoxaline
CID 71643111
2-methoxy-3-[[(3S)-pyrrolidin-3-yl]methoxy]quinoxaline
CID 97164916
N-cyclopropyl-3-[(3R)-piperidin-3-yl]oxyquinoxalin-2-amine
CID 71637298
3-methyl-2-(pyrrolidin-3-ylmethoxy)quinoline
CID 63228996
2-N-cyclopropyl-3-N-methyl-3-N-(pyrrolidin-3-ylmethyl)quinoxaline-2,3-diamine;hydrochloride
CID 71642304
2-methyl-3-(piperidin-3-ylmethoxy)quinoxaline
CID 55067629
2-ethoxy-3-(piperidin-3-ylmethoxy)quinoxaline
CID 71639733
3-[[(3S)-piperidin-3-yl]methoxy]quinoxalin-2-amine
CID 97165192
2-chloro-3-(piperidin-4-ylmethoxy)quinoxaline
CID 71640763
3-(piperidin-4-ylmethoxy)quinoxalin-2-amine
CID 71644088
2-(pyrrolidin-3-ylmethoxy)-1,3-benzothiazole
CID 62372647

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine?
The IUPAC name of N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine (CID 97178411) is N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine.
What is the SMILES notation for N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine?
The canonical SMILES for N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine is c1ccc2nc(OC[C@@H]3CCNC3)c(NC3CC3)nc2c1.
What is the InChIKey of N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine?
The InChIKey is BBOVWSNXRWHVPP-LLVKDONJSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-4-14-13(3-1)19-15(18-12-5-6-12)16(20-14)21-10-11-7-8-17-9-11/h1-4,11-12,17H,5-10H2,(H,18,19)/t11-/m1/s1.
What are the key properties of N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine?
N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine has a molecular weight of 284.36 g/mol, XLogP of 2.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[[(3R)-pyrrolidin-3-yl]methoxy]quinoxalin-2-amine is sourced from PubChem (CID 97178411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).